#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hxy n THR 39 N 0.00 0.00 0.33 0.52 -2.24 -1.26 -4.40 114.28 107.23 2hxy n THR 39 Ca 0.00 -2.22 0.12 0.00 -2.27 0.00 0.00 64.05 59.68 2hxy n THR 39 Cb 0.00 0.82 0.21 0.00 -2.10 0.00 0.00 70.33 69.27 2hxy n THR 39 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 2hxy h PHE 40 N 1.66 0.00 -0.34 4.78 0.04 -1.96 -3.33 116.94 117.79 2hxy h PHE 40 Ca -0.29 0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.50 2hxy h PHE 40 Cb 1.13 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 39.25 2hxy h PHE 40 CO 0.00 0.00 0.18 -0.44 -0.60 0.00 0.00 178.31 177.45 2hxy h ASP 41 N 0.00 0.27 0.00 2.17 3.32 -1.97 -2.56 116.42 117.66 2hxy h ASP 41 Ca 0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2hxy h ASP 41 Cb 0.92 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.43 2hxy h ASP 41 CO 0.00 0.20 0.00 0.35 -1.72 0.00 0.00 179.24 178.07 2hxy n THR 42 N -4.93 0.00 1.23 0.35 -2.24 -1.25 -3.44 114.28 104.00 2hxy n THR 42 Ca 0.00 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.91 2hxy n THR 42 Cb 0.07 -0.19 0.29 0.00 -2.10 0.00 0.00 70.33 68.41 2hxy n THR 42 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 2hxy n MET 43 N -0.62 1.77 -3.66 -0.78 2.81 -0.96 -4.96 117.12 110.71 2hxy n MET 43 Ca 0.05 -1.27 -0.22 0.00 -1.81 0.00 0.00 57.70 54.45 2hxy n MET 43 Cb 0.02 -1.47 0.05 0.00 -0.71 0.00 0.00 33.22 31.11 2hxy n MET 43 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2hxy n GLY 44 N 1.29 -0.36 3.88 3.03 0.00 -1.22 -4.97 105.19 106.83 2hxy n GLY 44 Ca 0.15 0.14 -0.32 0.00 0.00 0.00 0.00 46.02 45.99 2hxy n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hxy s LEU 45 N -6.75 4.20 0.68 0.99 1.43 -1.26 -5.04 118.68 112.93 2hxy s LEU 45 Ca 0.15 0.87 -0.17 0.00 -1.03 0.00 0.00 54.13 53.95 2hxy s LEU 45 Cb -0.07 -3.58 -0.01 0.00 0.03 0.00 0.00 46.19 42.56 2hxy s LEU 45 CO 0.79 -0.04 1.08 -2.11 0.23 0.00 0.00 176.35 176.30 2hxy n ARG 46 N -0.03 0.75 0.18 1.70 1.85 -1.26 -4.79 116.66 115.06 2hxy n ARG 46 Ca -0.00 0.31 -0.09 0.00 -1.00 0.00 0.00 57.85 57.07 2hxy n ARG 46 Cb 0.52 -2.32 -0.05 0.00 -1.05 0.00 0.00 32.46 29.57 2hxy n ARG 46 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 2hxy h GLU 47 N 0.10 -0.51 0.00 2.89 5.08 -1.99 -2.19 114.58 117.95 2hxy h GLU 47 Ca -0.49 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 2hxy h GLU 47 Cb 1.34 0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.71 2hxy h GLU 47 CO 0.49 -0.34 0.59 0.38 -1.00 0.00 0.00 179.01 179.13 2hxy h ASP 48 N -0.53 0.00 0.03 1.42 2.03 -1.93 0.25 116.42 117.69 2hxy h ASP 48 Ca -0.04 0.00 -0.29 0.00 -0.73 0.00 0.00 57.03 55.97 2hxy h ASP 48 Cb 0.44 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 38.90 2hxy h ASP 48 CO 0.02 0.00 -1.59 -0.11 -1.03 0.00 0.00 179.24 176.53 2hxy n LEU 49 N -2.43 2.08 0.05 0.15 7.94 -1.10 -3.31 117.00 120.38 2hxy n LEU 49 Ca -0.01 0.35 0.15 0.00 -1.11 0.00 0.00 56.01 55.39 2hxy n LEU 49 Cb 0.61 -0.99 0.63 0.00 0.53 0.00 0.00 43.42 44.20 2hxy n LEU 49 CO 0.06 0.46 1.15 0.25 -1.11 0.00 0.00 177.39 178.20 2hxy h LEU 50 N -0.72 0.10 0.06 -1.96 5.85 0.04 0.40 115.31 119.07 2hxy h LEU 50 Ca -0.41 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.31 2hxy h LEU 50 Cb 1.52 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.54 2hxy h LEU 50 CO -0.16 0.06 -0.03 -0.09 -0.34 0.00 0.00 178.44 177.88 2hxy h ARG 51 N 0.11 -0.08 -0.92 1.25 2.43 -1.14 -2.14 114.38 113.89 2hxy h ARG 51 Ca 0.19 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.42 2hxy h ARG 51 Cb 0.61 0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 30.11 2hxy h ARG 51 CO -0.02 0.26 0.59 0.78 -1.51 0.00 0.00 179.97 180.07 2hxy h GLY 52 N -0.42 1.38 0.62 2.80 0.00 -0.86 0.25 103.07 106.84 2hxy h GLY 52 Ca -0.01 -0.43 -0.00 0.00 0.00 0.00 0.00 47.33 46.89 2hxy h GLY 52 CO 0.01 0.31 -0.36 -2.22 0.00 0.00 0.00 176.54 174.29 2hxy h ILE 53 N 1.08 0.27 -0.51 2.60 2.04 -0.20 0.68 117.51 123.46 2hxy h ILE 53 Ca 0.39 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 66.20 2hxy h ILE 53 Cb 0.14 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 2hxy h ILE 53 CO -0.16 0.00 0.12 1.88 0.00 0.00 0.00 178.15 179.98 2hxy h TYR 54 N -0.74 0.80 -0.21 1.37 0.05 -0.98 -2.30 116.97 114.96 2hxy h TYR 54 Ca -0.02 -0.07 -0.11 0.00 0.05 0.00 0.00 58.73 58.58 2hxy h TYR 54 Cb 0.66 -0.24 -0.01 0.00 1.01 0.00 0.00 36.73 38.16 2hxy h TYR 54 CO -0.21 0.68 -0.32 0.00 -1.05 0.00 0.00 178.16 177.27 2hxy h ALA 55 N 1.38 1.06 0.00 3.88 0.00 -0.09 -0.16 119.26 125.33 2hxy h ALA 55 Ca 0.17 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2hxy h ALA 55 Cb 0.29 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2hxy h ALA 55 CO -0.00 0.58 0.00 -0.92 0.00 0.00 0.00 179.25 178.91 2hxy h TYR 56 N 0.37 0.00 0.00 0.00 3.20 0.88 -3.46 116.97 117.97 2hxy h TYR 56 Ca 0.05 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.92 2hxy h TYR 56 Cb 0.75 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.02 2hxy h TYR 56 CO 0.02 0.00 0.00 0.41 -1.64 0.00 0.00 178.16 176.95 2hxy n GLY 57 N -0.34 1.27 3.55 1.82 0.00 -0.07 -5.02 105.19 106.40 2hxy n GLY 57 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 2hxy n GLY 57 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2hxy s PHE 58 N -2.28 1.74 -0.15 1.61 5.36 -1.01 -4.82 117.98 118.42 2hxy s PHE 58 Ca 0.00 0.67 0.22 0.00 -0.96 0.00 0.00 56.93 56.86 2hxy s PHE 58 Cb 0.00 -4.12 -0.13 0.00 -0.34 0.00 0.00 43.02 38.42 2hxy s PHE 58 CO 0.00 -2.17 0.81 0.39 -1.46 0.00 0.00 175.22 172.79 2hxy n GLU 59 N 9.13 0.63 -3.68 10.12 1.02 -1.26 -4.10 120.64 132.50 2hxy n GLU 59 Ca 0.24 0.02 -0.10 0.00 -0.02 0.00 0.00 57.16 57.30 2hxy n GLU 59 Cb 0.51 -1.71 -0.11 0.00 -0.02 0.00 0.00 31.44 30.11 2hxy n GLU 59 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2hxy s LYS 60 N -3.35 0.33 0.41 3.49 2.20 -1.26 -4.78 119.74 116.77 2hxy s LYS 60 Ca -0.04 0.86 -0.22 0.00 -0.36 0.00 0.00 55.97 56.22 2hxy s LYS 60 Cb 0.11 0.10 -0.11 0.00 -1.51 0.00 0.00 37.83 36.43 2hxy s LYS 60 CO 0.83 -0.21 0.96 -1.25 -0.36 0.00 0.00 175.35 175.32 2hxy s PRO 61 N 1.95 4.29 1.28 4.03 0.04 -1.26 -5.06 135.00 140.27 2hxy s PRO 61 Ca -0.05 1.20 -0.16 0.00 0.04 0.00 0.00 61.00 62.02 2hxy s PRO 61 Cb -0.10 -2.34 0.32 0.00 0.04 0.00 0.00 34.50 32.43 2hxy s PRO 61 CO -0.12 0.02 0.98 0.45 0.04 0.00 0.00 177.00 178.37 2hxy s SER 62 N -2.01 0.07 -0.00 6.66 0.15 -1.26 -4.79 113.70 112.51 2hxy s SER 62 Ca 0.59 1.29 -0.22 0.00 0.70 0.00 0.00 55.95 58.31 2hxy s SER 62 Cb -0.12 -1.96 -0.20 0.00 -1.71 0.00 0.00 66.02 62.04 2hxy s SER 62 CO 0.16 -4.73 1.18 0.00 1.20 0.00 0.00 173.24 171.06 2hxy h ALA 63 N -2.98 0.12 -0.11 5.45 0.00 -1.97 -2.56 119.26 117.21 2hxy h ALA 63 Ca -0.57 -0.42 -0.09 0.00 0.00 0.00 0.00 54.91 53.83 2hxy h ALA 63 Cb 1.34 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2hxy h ALA 63 CO 0.43 0.13 -0.28 -0.84 0.00 0.00 0.00 179.25 178.69 2hxy h ILE 64 N -0.22 1.39 -0.83 0.00 -0.00 -2.01 -3.12 117.51 112.72 2hxy h ILE 64 Ca -0.02 -1.59 0.13 0.00 -0.00 0.00 0.00 64.86 63.38 2hxy h ILE 64 Cb 0.92 2.13 -0.06 0.00 -0.00 0.00 0.00 36.82 39.81 2hxy h ILE 64 CO 0.06 0.47 0.54 1.56 -0.00 0.00 0.00 178.15 180.77 2hxy h GLN 65 N -0.05 0.62 -0.58 0.16 4.20 -1.93 0.28 115.11 117.83 2hxy h GLN 65 Ca -0.00 -0.04 0.02 0.00 0.06 0.00 0.00 58.65 58.69 2hxy h GLN 65 Cb 0.89 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 28.49 2hxy h GLN 65 CO 0.06 0.41 0.35 0.37 -0.67 0.00 0.00 178.83 179.36 2hxy h GLN 66 N 0.64 0.68 0.32 1.46 4.15 -1.39 -0.59 115.11 120.38 2hxy h GLN 66 Ca 0.40 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.77 2hxy h GLN 66 Cb 0.66 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 28.19 2hxy h GLN 66 CO -0.16 0.45 -0.21 -0.09 -1.93 0.00 0.00 178.83 176.89 2hxy h ARG 67 N 0.70 -0.50 -0.36 1.69 2.43 -0.51 0.38 114.38 118.22 2hxy h ARG 67 Ca 0.23 0.03 0.05 0.00 -0.81 0.00 0.00 59.98 59.48 2hxy h ARG 67 Cb 0.01 0.11 -0.08 0.00 -0.42 0.00 0.00 29.97 29.59 2hxy h ARG 67 CO -0.09 -0.33 -0.53 0.00 -1.51 0.00 0.00 179.97 177.50 2hxy h ALA 68 N 0.13 -0.73 0.32 2.80 0.00 -0.79 0.50 119.26 121.48 2hxy h ALA 68 Ca -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2hxy h ALA 68 Cb 0.44 1.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.27 2hxy h ALA 68 CO 0.02 -1.02 -0.34 0.82 0.00 0.00 0.00 179.25 178.73 2hxy h ILE 69 N -0.42 0.00 -0.91 0.00 2.04 -0.89 0.13 117.51 117.46 2hxy h ILE 69 Ca 0.08 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.12 2hxy h ILE 69 Cb 0.61 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 36.52 2hxy h ILE 69 CO -0.56 0.00 -0.24 0.50 0.00 0.00 0.00 178.15 177.85 2hxy h LYS 70 N -0.67 -0.00 -0.37 2.37 1.63 0.32 -0.99 116.57 118.85 2hxy h LYS 70 Ca -0.04 0.00 -0.13 0.00 -0.85 0.00 0.00 60.65 59.63 2hxy h LYS 70 Cb 0.58 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.20 2hxy h LYS 70 CO -0.05 -0.00 -0.27 1.96 -3.45 0.00 0.00 179.45 177.63 2hxy h GLN 71 N -0.00 0.78 -0.36 1.90 1.08 0.32 -2.35 115.11 116.48 2hxy h GLN 71 Ca 0.43 -0.34 -0.10 0.00 -1.45 0.00 0.00 58.65 57.18 2hxy h GLN 71 Cb 0.66 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 28.05 2hxy h GLN 71 CO -0.93 0.97 -0.19 0.82 -0.95 0.00 0.00 178.83 178.54 2hxy h ILE 72 N 0.67 1.26 -0.45 2.54 2.04 0.50 -2.80 117.51 121.28 2hxy h ILE 72 Ca 0.08 -1.26 -0.03 0.00 1.00 0.00 0.00 64.86 64.65 2hxy h ILE 72 Cb 0.80 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 38.06 2hxy h ILE 72 CO 0.07 0.42 0.15 0.40 0.00 0.00 0.00 178.15 179.19 2hxy h ILE 73 N 0.61 1.22 -0.51 -0.67 2.04 -1.13 -1.60 117.51 117.47 2hxy h ILE 73 Ca 0.09 -0.71 0.15 0.00 1.00 0.00 0.00 64.86 65.39 2hxy h ILE 73 Cb 0.66 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 2hxy h ILE 73 CO 0.05 0.26 0.43 0.11 0.00 0.00 0.00 178.15 179.00 2hxy h LYS 74 N 0.59 0.00 0.00 2.37 1.79 -1.16 -3.45 116.57 116.71 2hxy h LYS 74 Ca 0.15 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.62 2hxy h LYS 74 Cb 0.25 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.90 2hxy h LYS 74 CO -0.01 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 178.77 2hxy n GLY 75 N -1.57 1.76 3.63 3.86 0.00 -0.60 -5.09 105.19 107.17 2hxy n GLY 75 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 2hxy n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hxy n ARG 76 N -0.76 0.98 -2.56 1.61 5.12 -1.13 -4.86 116.66 115.07 2hxy n ARG 76 Ca 0.00 0.38 -0.41 0.00 -1.93 0.00 0.00 57.85 55.89 2hxy n ARG 76 Cb 0.00 -2.20 -0.04 0.00 -1.16 0.00 0.00 32.46 29.05 2hxy n ARG 76 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2hxy s ASP 77 N -1.20 7.32 0.04 0.55 1.01 -1.26 -4.58 116.67 118.55 2hxy s ASP 77 Ca 0.75 2.05 0.07 0.00 0.71 0.00 0.00 52.55 56.14 2hxy s ASP 77 Cb -0.42 -2.60 -0.02 0.00 1.01 0.00 0.00 42.92 40.88 2hxy s ASP 77 CO 0.47 -0.17 -0.21 -0.69 0.21 0.00 0.00 175.17 174.78 2hxy s VAL 78 N -0.34 1.71 -0.46 -1.27 1.01 -1.14 0.32 120.40 120.24 2hxy s VAL 78 Ca 0.48 -1.18 0.03 0.00 0.00 0.00 0.00 61.98 61.31 2hxy s VAL 78 Cb -0.28 -1.48 0.13 0.00 0.00 0.00 0.00 36.38 34.74 2hxy s VAL 78 CO 0.34 0.26 0.22 -0.63 0.00 0.00 0.00 175.10 175.29 2hxy s ILE 79 N -0.76 2.13 -0.23 2.22 1.01 0.07 0.05 121.20 125.68 2hxy s ILE 79 Ca 0.08 -2.89 -0.10 0.00 0.00 0.00 0.00 60.65 57.74 2hxy s ILE 79 Cb -0.09 -2.50 -0.05 0.00 0.01 0.00 0.00 42.46 39.84 2hxy s ILE 79 CO 0.01 -0.80 0.15 0.00 0.00 0.00 0.00 174.94 174.30 2hxy s ALA 80 N 0.13 3.59 -0.23 9.38 0.00 -0.82 -0.61 121.76 133.20 2hxy s ALA 80 Ca 0.16 -0.87 -0.25 0.00 0.00 0.00 0.00 51.96 51.00 2hxy s ALA 80 Cb -0.24 -2.27 -0.01 0.00 0.00 0.00 0.00 23.12 20.60 2hxy s ALA 80 CO -0.02 -0.14 0.84 -1.14 0.00 0.00 0.00 175.76 175.29 2hxy s GLN 81 N 0.96 4.20 0.46 0.00 0.74 -0.60 -1.74 119.66 123.68 2hxy s GLN 81 Ca 0.07 0.97 -0.23 0.00 0.05 0.00 0.00 55.36 56.22 2hxy s GLN 81 Cb -0.13 -3.64 -0.07 0.00 1.10 0.00 0.00 33.01 30.27 2hxy s GLN 81 CO 0.04 -0.50 1.16 0.45 -0.55 0.00 0.00 175.29 175.89 2hxy s SER 82 N 1.31 6.19 -0.02 6.67 0.15 -0.63 -4.85 113.70 122.53 2hxy s SER 82 Ca 0.36 2.30 0.00 0.00 0.70 0.00 0.00 55.95 59.31 2hxy s SER 82 Cb -0.15 -2.60 0.02 0.00 -1.71 0.00 0.00 66.02 61.58 2hxy s SER 82 CO 0.08 -0.90 0.01 -1.58 1.20 0.00 0.00 173.24 172.05 2hxy s GLN 83 N -2.68 0.11 -0.39 5.44 0.74 -1.26 -4.34 119.66 117.28 2hxy s GLN 83 Ca 0.63 0.10 -0.38 0.00 0.05 0.00 0.00 55.36 55.76 2hxy s GLN 83 Cb -0.28 -0.30 -0.14 0.00 1.10 0.00 0.00 33.01 33.39 2hxy s GLN 83 CO 0.35 -0.11 2.17 0.43 -0.55 0.00 0.00 175.29 177.57 2hxy n SER 84 N 3.91 1.73 0.00 6.67 7.64 -1.26 -4.72 113.62 127.60 2hxy n SER 84 Ca -0.24 0.50 0.00 0.00 1.01 0.00 0.00 58.87 60.14 2hxy n SER 84 Cb 0.52 -1.16 0.00 0.00 -1.01 0.00 0.00 64.21 62.57 2hxy n SER 84 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2hxy n GLY 85 N 6.79 2.05 3.73 0.23 0.00 -1.26 -5.15 105.19 111.59 2hxy n GLY 85 Ca 0.45 -0.36 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 2hxy n GLY 85 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2hxy s THR 86 N -1.05 5.11 -0.63 2.61 2.01 -1.26 -4.61 115.64 117.83 2hxy s THR 86 Ca 0.00 1.08 -0.08 0.00 0.31 0.00 0.00 61.69 63.00 2hxy s THR 86 Cb 0.00 -3.87 0.01 0.00 0.01 0.00 0.00 72.50 68.65 2hxy s THR 86 CO 0.00 0.34 0.41 0.61 -0.69 0.00 0.00 174.62 175.28 2hxy n GLY 87 N 3.05 -0.73 0.00 4.40 0.00 -1.26 -4.75 105.19 105.89 2hxy n GLY 87 Ca -0.06 0.33 0.12 0.00 0.00 0.00 0.00 46.02 46.41 2hxy n GLY 87 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2hxy n LYS 88 N -2.52 0.52 -0.04 1.61 3.00 -1.26 -2.65 118.16 116.82 2hxy n LYS 88 Ca -0.16 0.03 -0.01 0.00 -0.00 0.00 0.00 58.31 58.17 2hxy n LYS 88 Cb 0.42 -1.50 -0.00 0.00 0.00 0.00 0.00 35.03 33.94 2hxy n LYS 88 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 2hxy h THR 89 N 0.00 0.00 -0.73 3.15 2.02 -1.97 -3.39 112.91 111.98 2hxy h THR 89 Ca 0.00 -0.66 0.15 0.00 0.77 0.00 0.00 66.41 66.66 2hxy h THR 89 Cb 0.15 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 66.42 2hxy h THR 89 CO 0.00 0.00 -0.17 0.00 0.37 0.00 0.00 175.52 175.72 2hxy h ALA 90 N -1.34 0.50 -1.00 6.16 0.00 -1.89 -1.56 119.26 120.13 2hxy h ALA 90 Ca 0.00 0.28 0.16 0.00 0.00 0.00 0.00 54.91 55.35 2hxy h ALA 90 Cb 0.14 0.55 -0.16 0.00 0.00 0.00 0.00 17.79 18.32 2hxy h ALA 90 CO 0.00 -0.41 -0.38 1.15 0.00 0.00 0.00 179.25 179.60 2hxy h THR 91 N 0.00 0.00 0.00 0.00 2.02 -1.70 1.05 112.91 114.29 2hxy h THR 91 Ca 0.35 0.00 -0.22 0.00 0.77 0.00 0.00 66.41 67.31 2hxy h THR 91 Cb 0.54 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.92 2hxy h THR 91 CO -0.75 0.00 -1.10 2.19 0.37 0.00 0.00 175.52 176.24 2hxy h PHE 92 N -0.00 0.01 -0.37 3.16 -5.15 -1.62 -3.07 116.94 109.89 2hxy h PHE 92 Ca 0.35 -0.01 0.02 0.00 -0.20 0.00 0.00 57.97 58.13 2hxy h PHE 92 Cb 0.60 -0.00 -0.02 0.00 0.22 0.00 0.00 35.95 36.75 2hxy h PHE 92 CO -0.87 1.01 0.22 0.77 -2.00 0.00 0.00 178.31 177.43 2hxy h SER 93 N 0.00 0.36 -0.84 -0.68 0.02 0.29 0.33 113.55 113.03 2hxy h SER 93 Ca -0.05 0.00 0.11 0.00 -0.84 0.00 0.00 61.79 61.01 2hxy h SER 93 Cb 1.81 -0.07 -0.08 0.00 0.14 0.00 0.00 62.40 64.20 2hxy h SER 93 CO 0.13 0.26 0.48 0.40 -1.14 0.00 0.00 176.83 176.95 2hxy h ILE 94 N 0.45 0.88 0.82 3.27 2.04 0.93 0.18 117.51 126.07 2hxy h ILE 94 Ca 0.15 -0.27 -0.04 0.00 1.00 0.00 0.00 64.86 65.70 2hxy h ILE 94 Cb 0.00 0.04 0.01 0.00 -0.74 0.00 0.00 36.82 36.13 2hxy h ILE 94 CO -0.07 0.14 -0.39 0.28 0.00 0.00 0.00 178.15 178.11 2hxy h SER 95 N 0.77 -0.93 -0.50 1.72 0.02 -0.99 -1.99 113.55 111.66 2hxy h SER 95 Ca 0.42 0.03 0.06 0.00 -0.84 0.00 0.00 61.79 61.45 2hxy h SER 95 Cb 0.42 0.24 -0.09 0.00 0.14 0.00 0.00 62.40 63.12 2hxy h SER 95 CO -0.27 -0.66 -0.56 0.58 -1.14 0.00 0.00 176.83 174.78 2hxy h VAL 96 N -1.11 0.00 -0.49 2.27 2.07 0.11 -1.73 116.25 117.37 2hxy h VAL 96 Ca -0.11 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.50 2hxy h VAL 96 Cb 0.84 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.51 2hxy h VAL 96 CO 0.18 0.00 -0.27 -0.07 0.02 0.00 0.00 177.57 177.43 2hxy h LEU 97 N -0.34 -0.93 -0.52 2.57 3.38 -0.66 -2.17 115.31 116.65 2hxy h LEU 97 Ca 0.09 0.19 0.10 0.00 0.09 0.00 0.00 57.88 58.35 2hxy h LEU 97 Cb 0.56 0.48 -0.10 0.00 0.09 0.00 0.00 40.66 41.69 2hxy h LEU 97 CO -0.65 -0.28 -0.14 -0.61 0.09 0.00 0.00 178.44 176.85 2hxy h GLN 98 N -0.16 -0.01 -3.47 1.13 5.75 -0.53 -3.09 115.11 114.73 2hxy h GLN 98 Ca 0.22 0.00 -0.71 0.00 -0.15 0.00 0.00 58.65 58.01 2hxy h GLN 98 Cb 0.51 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 29.02 2hxy h GLN 98 CO -0.58 -0.01 3.11 0.00 -2.65 0.00 0.00 178.83 178.70 2hxy s LEU 100 N 0.74 2.24 -0.56 0.00 1.43 -1.17 -4.97 118.68 116.39 2hxy s LEU 100 Ca 0.54 -1.09 0.04 0.00 -1.03 0.00 0.00 54.13 52.58 2hxy s LEU 100 Cb 0.15 0.07 0.15 0.00 0.03 0.00 0.00 46.19 46.59 2hxy s LEU 100 CO -0.07 -0.58 0.36 -0.62 0.23 0.00 0.00 176.35 175.67 2hxy s ASP 101 N -3.05 4.07 0.13 2.29 -1.08 -1.26 -5.00 116.67 112.76 2hxy s ASP 101 Ca 0.17 -3.27 -0.28 0.00 -0.52 0.00 0.00 52.55 48.64 2hxy s ASP 101 Cb 0.07 -1.38 -0.07 0.00 -1.46 0.00 0.00 42.92 40.07 2hxy s ASP 101 CO -0.02 -0.17 1.48 0.40 0.52 0.00 0.00 175.17 177.38 2hxy h ILE 102 N 4.91 0.00 0.00 4.11 1.08 -1.97 -0.41 117.51 125.23 2hxy h ILE 102 Ca 0.06 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.53 2hxy h ILE 102 Cb 0.85 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.60 2hxy h ILE 102 CO 0.62 0.00 0.37 0.00 -0.69 0.00 0.00 178.15 178.45 2hxy n GLN 103 N -5.02 0.03 -3.75 2.37 1.13 -1.26 -3.39 117.38 107.48 2hxy n GLN 103 Ca 0.00 0.34 -0.34 0.00 -1.94 0.00 0.00 57.00 55.06 2hxy n GLN 103 Cb 0.25 -1.96 -0.10 0.00 0.11 0.00 0.00 30.24 28.55 2hxy n GLN 103 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2hxy s VAL 104 N -2.74 3.65 -0.85 5.09 1.01 -0.16 -5.03 120.40 121.35 2hxy s VAL 104 Ca -0.00 -3.48 -0.25 0.00 0.00 0.00 0.00 61.98 58.25 2hxy s VAL 104 Cb 0.01 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.99 2hxy s VAL 104 CO 0.03 -0.95 1.94 -0.13 0.00 0.00 0.00 175.10 175.99 2hxy s ARG 105 N -0.69 2.55 -0.23 2.72 0.52 -1.22 -4.84 118.95 117.76 2hxy s ARG 105 Ca 0.21 -0.14 -0.27 0.00 -0.52 0.00 0.00 55.73 55.01 2hxy s ARG 105 Cb -0.15 -4.95 0.12 0.00 0.52 0.00 0.00 34.95 30.49 2hxy s ARG 105 CO -0.08 -3.29 1.02 -2.00 0.02 0.00 0.00 175.30 170.97 2hxy s GLU 106 N 7.04 0.54 -0.41 3.54 2.12 -1.26 -4.72 118.70 125.55 2hxy s GLU 106 Ca 0.70 0.41 -0.38 0.00 0.36 0.00 0.00 54.97 56.06 2hxy s GLU 106 Cb -0.08 0.26 -0.14 0.00 0.26 0.00 0.00 34.13 34.43 2hxy s GLU 106 CO 0.03 -0.11 2.18 2.41 -0.54 0.00 0.00 175.26 179.23 2hxy n THR 107 N 1.62 0.12 -0.02 -1.70 -1.04 -0.87 -4.47 114.28 107.92 2hxy n THR 107 Ca -0.12 -0.17 0.04 0.00 -2.04 0.00 0.00 64.05 61.76 2hxy n THR 107 Cb 0.57 -1.24 -0.10 0.00 -1.82 0.00 0.00 70.33 67.73 2hxy n THR 107 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2hxy n GLN 108 N 7.98 0.72 -3.95 -2.82 6.02 -0.58 -2.86 117.38 121.87 2hxy n GLN 108 Ca 0.46 -0.10 -0.15 0.00 -0.01 0.00 0.00 57.00 57.20 2hxy n GLN 108 Cb 0.14 -1.32 -0.15 0.00 1.02 0.00 0.00 30.24 29.92 2hxy n GLN 108 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2hxy s ALA 109 N -2.81 0.23 -0.11 -1.58 0.00 -1.16 0.19 121.76 116.51 2hxy s ALA 109 Ca -0.05 0.04 0.02 0.00 0.00 0.00 0.00 51.96 51.97 2hxy s ALA 109 Cb 0.08 -0.17 0.01 0.00 0.00 0.00 0.00 23.12 23.04 2hxy s ALA 109 CO 0.55 -0.01 -0.19 -1.17 0.00 0.00 0.00 175.76 174.94 2hxy s LEU 110 N 0.44 1.91 -0.13 0.00 2.96 0.06 -1.80 118.68 122.13 2hxy s LEU 110 Ca -0.04 -0.50 0.01 0.00 -0.22 0.00 0.00 54.13 53.38 2hxy s LEU 110 Cb -0.07 -1.24 -0.01 0.00 0.50 0.00 0.00 46.19 45.37 2hxy s LEU 110 CO -0.01 0.07 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.30 2hxy s ILE 111 N 0.77 2.78 -0.07 6.68 1.01 0.16 -0.67 121.20 131.87 2hxy s ILE 111 Ca -0.10 -0.75 0.01 0.00 0.00 0.00 0.00 60.65 59.81 2hxy s ILE 111 Cb -0.16 -2.15 -0.03 0.00 0.01 0.00 0.00 42.46 40.13 2hxy s ILE 111 CO 0.01 0.53 -0.10 -0.76 0.00 0.00 0.00 174.94 174.62 2hxy s LEU 112 N 0.46 2.99 0.12 2.97 1.43 0.07 -2.03 118.68 124.69 2hxy s LEU 112 Ca -0.11 -0.11 0.04 0.00 -1.03 0.00 0.00 54.13 52.91 2hxy s LEU 112 Cb -0.16 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.38 2hxy s LEU 112 CO 0.05 0.33 -0.09 0.00 0.23 0.00 0.00 176.35 176.87 2hxy s ALA 113 N -0.63 1.24 -0.47 4.21 0.00 -0.98 -1.86 121.76 123.28 2hxy s ALA 113 Ca 0.09 -1.36 0.24 0.00 0.00 0.00 0.00 51.96 50.93 2hxy s ALA 113 Cb -0.11 0.06 0.99 0.00 0.00 0.00 0.00 23.12 24.06 2hxy s ALA 113 CO 0.01 -0.10 1.72 -0.35 0.00 0.00 0.00 175.76 177.04 2hxy n PRO 114 N 0.08 0.21 -3.86 0.00 -0.04 -1.26 -3.95 135.00 126.19 2hxy n PRO 114 Ca -0.13 0.42 -0.11 0.00 -0.04 0.00 0.00 63.50 63.64 2hxy n PRO 114 Cb 0.60 -1.88 -0.11 0.00 -0.04 0.00 0.00 33.50 32.07 2hxy n PRO 114 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2hxy s THR 115 N -3.32 0.06 0.12 0.52 -4.23 -1.26 -4.96 115.64 102.56 2hxy s THR 115 Ca 0.04 -0.48 -0.30 0.00 -1.18 0.00 0.00 61.69 59.77 2hxy s THR 115 Cb 0.09 -0.37 -0.09 0.00 1.34 0.00 0.00 72.50 73.48 2hxy s THR 115 CO 0.41 -0.26 1.58 0.03 -0.54 0.00 0.00 174.62 175.84 2hxy h ARG 116 N 4.79 -0.58 -0.61 3.99 3.08 -1.94 0.37 114.38 123.48 2hxy h ARG 116 Ca -0.29 0.04 0.07 0.00 0.07 0.00 0.00 59.98 59.87 2hxy h ARG 116 Cb 1.20 0.13 -0.10 0.00 0.08 0.00 0.00 29.97 31.28 2hxy h ARG 116 CO 0.41 -0.39 -0.55 0.93 -1.07 0.00 0.00 179.97 179.30 2hxy h GLU 117 N -0.60 -0.25 -0.96 0.04 3.07 -1.99 -0.03 114.58 113.86 2hxy h GLU 117 Ca 0.04 0.02 0.03 0.00 -0.50 0.00 0.00 59.36 58.95 2hxy h GLU 117 Cb 0.66 0.06 -0.06 0.00 -0.84 0.00 0.00 28.75 28.58 2hxy h GLU 117 CO -0.30 -0.17 0.63 1.25 -1.40 0.00 0.00 179.01 179.02 2hxy h LEU 118 N -0.26 1.05 -0.66 1.33 5.85 -1.83 -1.55 115.31 119.24 2hxy h LEU 118 Ca 0.11 -0.01 0.12 0.00 0.84 0.00 0.00 57.88 58.94 2hxy h LEU 118 Cb 0.54 -0.24 -0.08 0.00 0.37 0.00 0.00 40.66 41.24 2hxy h LEU 118 CO -0.71 0.73 0.23 0.00 -0.34 0.00 0.00 178.44 178.34 2hxy h ALA 119 N 1.39 0.87 0.29 1.25 0.00 0.15 -1.51 119.26 121.69 2hxy h ALA 119 Ca 0.38 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.38 2hxy h ALA 119 Cb -0.02 0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2hxy h ALA 119 CO -0.12 -0.23 -0.14 0.28 0.00 0.00 0.00 179.25 179.05 2hxy h VAL 120 N 0.38 0.75 -0.74 0.00 2.07 -0.45 -2.81 116.25 115.44 2hxy h VAL 120 Ca 0.35 -0.24 0.13 0.00 0.82 0.00 0.00 66.70 67.76 2hxy h VAL 120 Cb 0.50 0.88 -0.14 0.00 -1.52 0.00 0.00 31.29 31.01 2hxy h VAL 120 CO -0.37 0.05 -0.29 1.56 0.02 0.00 0.00 177.57 178.54 2hxy h GLN 121 N -0.51 -0.07 -0.90 1.57 4.20 -0.47 0.69 115.11 119.62 2hxy h GLN 121 Ca -0.04 0.00 0.20 0.00 0.06 0.00 0.00 58.65 58.88 2hxy h GLN 121 Cb 0.38 0.02 -0.11 0.00 0.30 0.00 0.00 27.48 28.06 2hxy h GLN 121 CO 0.06 -0.04 0.44 0.82 -0.67 0.00 0.00 178.83 179.44 2hxy h ILE 122 N -0.07 0.57 0.48 2.54 2.04 -1.17 0.31 117.51 122.20 2hxy h ILE 122 Ca 0.31 -0.17 -0.02 0.00 1.00 0.00 0.00 64.86 65.98 2hxy h ILE 122 Cb 0.57 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.68 2hxy h ILE 122 CO -0.79 0.09 -0.23 -0.61 0.00 0.00 0.00 178.15 176.61 2hxy h GLN 123 N 0.50 -0.62 -1.17 2.37 4.15 0.51 0.56 115.11 121.42 2hxy h GLN 123 Ca 0.54 0.04 0.35 0.00 0.77 0.00 0.00 58.65 60.35 2hxy h GLN 123 Cb 0.95 0.14 -0.11 0.00 0.21 0.00 0.00 27.48 28.67 2hxy h GLN 123 CO -0.47 -0.41 0.75 0.87 -1.93 0.00 0.00 178.83 177.64 2hxy h LYS 124 N -0.89 0.23 0.00 1.69 1.57 -0.08 0.36 116.57 119.45 2hxy h LYS 124 Ca -0.07 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2hxy h LYS 124 Cb 0.49 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.75 2hxy h LYS 124 CO 0.11 0.15 -0.00 0.78 -0.57 0.00 0.00 179.45 179.92 2hxy h GLY 125 N 0.23 -0.00 0.44 3.86 0.00 -0.36 -1.64 103.07 105.60 2hxy h GLY 125 Ca 0.71 0.00 0.08 0.00 0.00 0.00 0.00 47.33 48.12 2hxy h GLY 125 CO -0.37 -0.00 0.14 1.41 0.00 0.00 0.00 176.54 177.72 2hxy h LEU 126 N -0.61 0.10 -0.67 3.11 3.38 0.20 0.15 115.31 120.96 2hxy h LEU 126 Ca -0.00 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2hxy h LEU 126 Cb 0.61 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 2hxy h LEU 126 CO 0.00 0.08 0.39 -0.07 0.09 0.00 0.00 178.44 178.93 2hxy h LEU 127 N 0.30 0.82 -1.40 1.67 3.38 -0.81 -0.92 115.31 118.35 2hxy h LEU 127 Ca 0.24 -0.08 -0.06 0.00 0.09 0.00 0.00 57.88 58.08 2hxy h LEU 127 Cb 0.30 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2hxy h LEU 127 CO -0.28 0.66 -0.22 0.00 0.09 0.00 0.00 178.44 178.68 2hxy h ALA 128 N 1.20 1.51 0.01 1.53 0.00 -0.28 0.62 119.26 123.83 2hxy h ALA 128 Ca 0.24 -0.24 -0.21 0.00 0.00 0.00 0.00 54.91 54.70 2hxy h ALA 128 Cb 0.00 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2hxy h ALA 128 CO -0.04 0.36 -1.00 -0.07 0.00 0.00 0.00 179.25 178.50 2hxy h LEU 129 N 0.11 0.02 -3.12 0.00 3.38 0.12 -3.28 115.31 112.54 2hxy h LEU 129 Ca 0.02 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2hxy h LEU 129 Cb 0.46 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2hxy h LEU 129 CO 0.03 1.01 0.00 0.61 0.09 0.00 0.00 178.44 180.18 2hxy n GLY 130 N 1.33 3.19 0.57 0.83 0.00 -0.43 -4.05 105.19 106.63 2hxy n GLY 130 Ca -0.01 -0.77 0.44 0.00 0.00 0.00 0.00 46.02 45.68 2hxy n GLY 130 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2hxy h ASP 131 N 2.72 0.12 -0.47 1.61 -0.00 -0.94 2.24 116.42 121.70 2hxy h ASP 131 Ca 0.00 0.07 0.00 0.00 -0.00 0.00 0.00 57.03 57.10 2hxy h ASP 131 Cb 1.25 0.07 0.00 0.00 -0.00 0.00 0.00 39.33 40.65 2hxy h ASP 131 CO 0.17 -0.11 0.00 -1.22 -0.00 0.00 0.00 179.24 178.08 2hxy n TYR 132 N -4.36 0.86 0.11 0.28 4.01 -1.26 -3.69 117.16 113.11 2hxy n TYR 132 Ca 0.39 -0.37 0.03 0.00 -0.16 0.00 0.00 57.90 57.79 2hxy n TYR 132 Cb 1.66 -0.10 0.04 0.00 -0.31 0.00 0.00 39.34 40.64 2hxy n TYR 132 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 2hxy n MET 133 N 0.80 1.01 -4.04 -0.72 2.81 0.75 -4.77 117.12 112.96 2hxy n MET 133 Ca 0.17 -1.20 -0.43 0.00 -1.81 0.00 0.00 57.70 54.43 2hxy n MET 133 Cb 0.54 -1.12 0.01 0.00 -0.71 0.00 0.00 33.22 31.95 2hxy n MET 133 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 2hxy n ASN 134 N 0.20 -3.69 -4.87 7.83 5.15 -1.17 -4.91 115.26 113.81 2hxy n ASN 134 Ca 0.04 -1.25 -0.34 0.00 -0.60 0.00 0.00 54.58 52.43 2hxy n ASN 134 Cb 0.22 -1.96 -0.06 0.00 -0.53 0.00 0.00 39.78 37.46 2hxy n ASN 134 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2hxy s VAL 135 N -3.62 5.28 -0.21 3.44 0.11 -1.26 -5.09 120.40 119.05 2hxy s VAL 135 Ca 0.43 -0.14 -0.08 0.00 -2.93 0.00 0.00 61.98 59.26 2hxy s VAL 135 Cb -0.22 -3.42 -0.04 0.00 -1.53 0.00 0.00 36.38 31.17 2hxy s VAL 135 CO 0.96 0.40 0.08 -1.10 -3.33 0.00 0.00 175.10 172.11 2hxy s GLN 136 N -1.69 3.93 -0.08 1.54 -1.52 -1.26 -4.99 119.66 115.58 2hxy s GLN 136 Ca 0.24 -0.36 -0.04 0.00 -1.95 0.00 0.00 55.36 53.24 2hxy s GLN 136 Cb -0.12 -3.30 0.04 0.00 -0.22 0.00 0.00 33.01 29.41 2hxy s GLN 136 CO 0.14 0.14 0.19 0.00 -0.25 0.00 0.00 175.29 175.51 2hxy s HIS 138 N 1.00 1.25 -0.11 0.00 2.46 -0.54 -4.98 115.29 114.37 2hxy s HIS 138 Ca -0.07 -0.58 0.01 0.00 0.47 0.00 0.00 55.06 54.89 2hxy s HIS 138 Cb -0.09 -0.67 -0.01 0.00 -0.13 0.00 0.00 32.58 31.68 2hxy s HIS 138 CO -0.06 0.08 -0.16 0.00 -2.47 0.00 0.00 174.74 172.14 2hxy s ALA 139 N -2.15 2.53 0.00 1.58 0.00 -1.26 -1.39 121.76 121.09 2hxy s ALA 139 Ca 0.06 -0.92 -0.06 0.00 0.00 0.00 0.00 51.96 51.04 2hxy s ALA 139 Cb -0.05 -1.08 -0.05 0.00 0.00 0.00 0.00 23.12 21.94 2hxy s ALA 139 CO 0.02 0.31 0.25 0.00 0.00 0.00 0.00 175.76 176.34 2hxy n ILE 141 N 1.10 0.00 0.00 0.00 5.41 -1.26 -4.36 119.36 120.25 2hxy n ILE 141 Ca -0.11 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.64 2hxy n ILE 141 Cb 0.53 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.46 2hxy n ILE 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2hxy n GLY 142 N -1.97 1.89 0.00 7.39 0.00 -1.26 -4.70 105.19 106.54 2hxy n GLY 142 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.52 2hxy n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hxy n GLY 143 N 0.00 3.16 0.02 -0.02 0.00 -1.26 -4.64 105.19 102.45 2hxy n GLY 143 Ca 0.00 -0.87 0.11 0.00 0.00 0.00 0.00 46.02 45.25 2hxy n GLY 143 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2hxy n THR 144 N 0.00 0.57 0.46 2.61 -1.04 -1.26 -2.74 114.28 112.88 2hxy n THR 144 Ca 0.00 0.12 0.05 0.00 -2.04 0.00 0.00 64.05 62.17 2hxy n THR 144 Cb 0.00 -0.79 -0.04 0.00 -1.82 0.00 0.00 70.33 67.68 2hxy n THR 144 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2hxy n ASN 145 N -1.61 0.61 -0.65 8.00 2.85 -1.26 -4.71 115.26 118.50 2hxy n ASN 145 Ca 0.05 -0.81 0.50 0.00 -0.11 0.00 0.00 54.58 54.21 2hxy n ASN 145 Cb 0.26 0.89 0.78 0.00 1.24 0.00 0.00 39.78 42.95 2hxy n ASN 145 CO 0.00 0.00 0.00 1.33 -2.11 0.00 0.00 177.26 176.48 2hxy n VAL 146 N -1.03 -0.05 -0.04 3.44 0.24 -1.11 0.87 118.33 120.65 2hxy n VAL 146 Ca 0.02 1.52 -0.14 0.00 -2.04 0.00 0.00 64.34 63.70 2hxy n VAL 146 Cb 0.16 -2.53 -0.09 0.00 -1.47 0.00 0.00 33.84 29.92 2hxy n VAL 146 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2hxy h GLY 147 N 0.00 0.38 1.64 7.63 0.00 -1.84 -0.70 103.07 110.18 2hxy h GLY 147 Ca 0.91 -0.47 -0.10 0.00 0.00 0.00 0.00 47.33 47.67 2hxy h GLY 147 CO -0.10 0.42 -0.28 -2.09 0.00 0.00 0.00 176.54 174.49 2hxy h GLU 148 N -0.11 0.41 0.56 4.80 4.57 0.14 0.19 114.58 125.14 2hxy h GLU 148 Ca -0.01 -0.16 -0.02 0.00 -1.18 0.00 0.00 59.36 58.00 2hxy h GLU 148 Cb 0.87 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.42 2hxy h GLU 148 CO 0.06 0.66 -0.49 -0.44 -1.18 0.00 0.00 179.01 177.61 2hxy h ASP 149 N 0.36 -1.33 -0.14 1.04 5.19 0.06 -1.37 116.42 120.23 2hxy h ASP 149 Ca 0.05 0.10 -0.07 0.00 -0.62 0.00 0.00 57.03 56.49 2hxy h ASP 149 Cb 0.69 0.43 -0.02 0.00 0.18 0.00 0.00 39.33 40.61 2hxy h ASP 149 CO 0.05 -0.67 -0.11 0.40 -3.12 0.00 0.00 179.24 175.79 2hxy h ILE 150 N -1.03 1.23 -0.30 0.35 2.04 -1.00 -2.42 117.51 116.37 2hxy h ILE 150 Ca -0.07 -0.99 0.07 0.00 1.00 0.00 0.00 64.86 64.87 2hxy h ILE 150 Cb 0.88 1.12 -0.07 0.00 -0.74 0.00 0.00 36.82 38.02 2hxy h ILE 150 CO -0.02 0.32 -0.14 -0.09 0.00 0.00 0.00 178.15 178.23 2hxy h ARG 151 N 0.46 -0.08 -0.17 2.37 2.43 -0.22 -2.85 114.38 116.31 2hxy h ARG 151 Ca 0.09 0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.16 2hxy h ARG 151 Cb 0.47 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.04 2hxy h ARG 151 CO 0.03 -0.06 -0.28 0.87 -1.51 0.00 0.00 179.97 179.02 2hxy h LYS 152 N -0.09 0.49 -1.27 0.20 1.57 -1.08 -3.11 116.57 113.28 2hxy h LYS 152 Ca 0.16 -0.30 0.37 0.00 -1.87 0.00 0.00 60.65 59.00 2hxy h LYS 152 Cb 0.32 0.03 -0.07 0.00 0.08 0.00 0.00 32.23 32.59 2hxy h LYS 152 CO -0.36 0.90 0.89 -0.07 -0.57 0.00 0.00 179.45 180.23 2hxy h LEU 153 N 0.13 0.14 0.07 2.94 3.38 -1.23 0.46 115.31 121.19 2hxy h LEU 153 Ca 0.01 0.04 -0.25 0.00 0.09 0.00 0.00 57.88 57.77 2hxy h LEU 153 Cb 0.86 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 2hxy h LEU 153 CO 0.06 -0.01 -1.16 0.44 0.09 0.00 0.00 178.44 177.87 2hxy h ASP 154 N 0.10 0.30 0.11 -0.43 3.32 -1.45 -2.95 116.42 115.43 2hxy h ASP 154 Ca 0.66 -0.32 0.00 0.00 0.02 0.00 0.00 57.03 57.39 2hxy h ASP 154 Cb 2.33 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 41.78 2hxy h ASP 154 CO -0.13 1.24 0.00 0.22 -1.72 0.00 0.00 179.24 178.85 2hxy h TYR 155 N 0.06 0.00 -0.64 4.55 3.20 -0.05 -3.46 116.97 120.62 2hxy h TYR 155 Ca -0.10 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.77 2hxy h TYR 155 Cb 1.89 0.00 0.00 0.00 1.54 0.00 0.00 36.73 40.16 2hxy h TYR 155 CO 0.04 0.00 0.00 0.41 -1.64 0.00 0.00 178.16 176.97 2hxy n GLY 156 N -1.07 -0.67 3.50 1.82 0.00 -0.97 -4.97 105.19 102.83 2hxy n GLY 156 Ca -0.01 -0.67 -0.43 0.00 0.00 0.00 0.00 46.02 44.91 2hxy n GLY 156 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2hxy s GLN 157 N -0.08 3.23 0.47 1.61 -1.52 -1.25 -4.59 119.66 117.52 2hxy s GLN 157 Ca 0.00 -0.60 0.21 0.00 -1.95 0.00 0.00 55.36 53.02 2hxy s GLN 157 Cb 0.00 -3.93 1.21 0.00 -0.22 0.00 0.00 33.01 30.07 2hxy s GLN 157 CO 0.00 -0.82 1.91 0.45 -0.25 0.00 0.00 175.29 176.58 2hxy h HIS 158 N 8.70 0.31 -3.21 0.91 3.86 -1.29 -2.32 115.15 122.12 2hxy h HIS 158 Ca -0.27 0.01 -0.19 0.00 -1.16 0.00 0.00 60.37 58.77 2hxy h HIS 158 Cb 1.11 -0.10 -0.27 0.00 1.06 0.00 0.00 27.41 29.21 2hxy h HIS 158 CO 0.66 0.10 -0.49 0.08 0.86 0.00 0.00 177.93 179.13 2hxy s VAL 159 N -5.25 -0.01 0.02 2.45 1.01 -1.18 -1.53 120.40 115.91 2hxy s VAL 159 Ca -0.07 0.04 0.06 0.00 0.00 0.00 0.00 61.98 62.02 2hxy s VAL 159 Cb 0.21 -0.30 -0.02 0.00 0.00 0.00 0.00 36.38 36.27 2hxy s VAL 159 CO 0.76 0.02 -0.19 -0.69 0.00 0.00 0.00 175.10 175.01 2hxy s VAL 160 N 0.42 1.49 0.07 2.92 1.01 -0.75 -1.47 120.40 124.09 2hxy s VAL 160 Ca -0.03 -1.03 0.03 0.00 0.00 0.00 0.00 61.98 60.96 2hxy s VAL 160 Cb -0.04 -1.28 -0.03 0.00 0.00 0.00 0.00 36.38 35.03 2hxy s VAL 160 CO -0.02 0.23 -0.09 0.00 0.00 0.00 0.00 175.10 175.21 2hxy s ALA 161 N -0.69 0.86 0.00 5.51 0.00 -0.48 0.39 121.76 127.35 2hxy s ALA 161 Ca 0.06 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.05 2hxy s ALA 161 Cb -0.08 0.03 0.00 0.00 0.00 0.00 0.00 23.12 23.06 2hxy s ALA 161 CO 0.01 -0.01 0.00 0.41 0.00 0.00 0.00 175.76 176.17 2hxy n GLY 162 N 1.05 1.33 3.76 0.00 0.00 -0.86 0.17 105.19 110.64 2hxy n GLY 162 Ca -0.20 -0.93 -0.32 0.00 0.00 0.00 0.00 46.02 44.57 2hxy n GLY 162 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2hxy s THR 163 N -2.00 3.11 0.29 2.61 -4.23 -1.25 -2.31 115.64 111.86 2hxy s THR 163 Ca 0.00 0.45 0.02 0.00 -1.18 0.00 0.00 61.69 60.98 2hxy s THR 163 Cb 0.00 -2.93 0.29 0.00 1.34 0.00 0.00 72.50 71.20 2hxy s THR 163 CO 0.00 -0.39 1.84 -0.65 -0.54 0.00 0.00 174.62 174.89 2hxy h PRO 164 N -0.56 0.94 0.00 3.99 0.11 -1.94 -0.90 132.00 133.64 2hxy h PRO 164 Ca -0.45 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2hxy h PRO 164 Cb 1.25 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2hxy h PRO 164 CO 0.52 0.62 0.00 0.41 -0.21 0.00 0.00 178.00 179.34 2hxy n GLY 165 N -1.36 -2.56 0.25 -0.55 0.00 -1.26 -1.57 105.19 98.14 2hxy n GLY 165 Ca 0.18 0.06 0.03 0.00 0.00 0.00 0.00 46.02 46.30 2hxy n GLY 165 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2hxy h ARG 166 N 0.00 0.19 -0.89 1.61 9.65 -1.91 -0.60 114.38 122.43 2hxy h ARG 166 Ca 0.00 -0.01 0.07 0.00 -1.10 0.00 0.00 59.98 58.94 2hxy h ARG 166 Cb 0.00 -0.04 -0.07 0.00 -1.39 0.00 0.00 29.97 28.47 2hxy h ARG 166 CO 0.00 0.13 0.55 0.28 2.80 0.00 0.00 179.97 183.73 2hxy h VAL 167 N 0.19 1.02 -0.60 0.20 2.07 -1.16 -1.47 116.25 116.51 2hxy h VAL 167 Ca 0.37 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.52 2hxy h VAL 167 Cb 0.61 -0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 2hxy h VAL 167 CO -0.52 0.18 0.25 0.15 0.02 0.00 0.00 177.57 177.65 2hxy h PHE 168 N 0.98 0.90 0.48 1.57 3.57 -0.11 -2.56 116.94 121.78 2hxy h PHE 168 Ca 0.40 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.82 2hxy h PHE 168 Cb 0.22 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 2hxy h PHE 168 CO -0.03 0.71 -0.51 0.22 -2.23 0.00 0.00 178.31 176.48 2hxy h ASP 169 N 0.83 -1.41 -0.11 0.41 -0.00 -0.46 0.25 116.42 115.94 2hxy h ASP 169 Ca 0.20 0.11 0.03 0.00 -0.00 0.00 0.00 57.03 57.38 2hxy h ASP 169 Cb 0.18 0.47 -0.00 0.00 -0.00 0.00 0.00 39.33 39.98 2hxy h ASP 169 CO -0.02 -0.66 0.38 0.24 -0.00 0.00 0.00 179.24 179.18 2hxy h MET 170 N -1.00 0.00 0.18 0.28 2.86 -1.20 0.30 114.93 116.36 2hxy h MET 170 Ca -0.06 0.00 -0.34 0.00 -2.06 0.00 0.00 59.70 57.24 2hxy h MET 170 Cb 0.87 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.54 2hxy h MET 170 CO -0.08 0.00 -1.70 0.82 1.06 0.00 0.00 176.91 177.01 2hxy h ILE 171 N 0.00 0.96 -0.30 -1.22 2.04 -0.76 0.50 117.51 118.72 2hxy h ILE 171 Ca 0.05 -2.51 -0.03 0.00 1.00 0.00 0.00 64.86 63.37 2hxy h ILE 171 Cb 0.82 2.78 -0.01 0.00 -0.74 0.00 0.00 36.82 39.66 2hxy h ILE 171 CO -0.00 0.84 0.07 -0.09 0.00 0.00 0.00 178.15 178.97 2hxy h ARG 172 N 0.06 0.49 -0.11 2.37 2.43 0.26 -2.18 114.38 117.69 2hxy h ARG 172 Ca -0.34 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 2hxy h ARG 172 Cb 2.07 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 31.55 2hxy h ARG 172 CO 0.17 0.56 0.00 0.54 -1.51 0.00 0.00 179.97 179.73 2hxy n ARG 173 N -4.66 0.44 -1.33 0.20 1.74 0.73 -4.77 116.66 109.01 2hxy n ARG 173 Ca -0.02 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.93 2hxy n ARG 173 Cb 0.19 -1.06 -0.05 0.00 -1.02 0.00 0.00 32.46 30.52 2hxy n ARG 173 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2hxy n ARG 174 N -0.30 -1.45 0.06 5.56 3.00 -0.82 -4.80 116.66 117.90 2hxy n ARG 174 Ca 0.00 0.82 -0.18 0.00 -0.01 0.00 0.00 57.85 58.48 2hxy n ARG 174 Cb 0.03 -5.06 -0.14 0.00 0.00 0.00 0.00 32.46 27.29 2hxy n ARG 174 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.63 178.40 2hxy h SER 175 N 0.00 0.45 -3.70 0.55 0.02 -1.45 -3.45 113.55 105.97 2hxy h SER 175 Ca -0.26 -0.63 -0.62 0.00 -0.84 0.00 0.00 61.79 59.43 2hxy h SER 175 Cb 0.96 -0.15 -0.14 0.00 0.14 0.00 0.00 62.40 63.22 2hxy h SER 175 CO 0.38 1.53 -0.23 -0.22 -1.14 0.00 0.00 176.83 177.16 2hxy s LEU 176 N -7.05 4.05 -0.69 5.07 2.96 0.16 -4.66 118.68 118.52 2hxy s LEU 176 Ca -0.11 0.31 -0.24 0.00 -0.22 0.00 0.00 54.13 53.88 2hxy s LEU 176 Cb 0.06 -2.44 0.06 0.00 0.50 0.00 0.00 46.19 44.38 2hxy s LEU 176 CO 0.85 -0.18 1.06 -0.13 -1.32 0.00 0.00 176.35 176.63 2hxy s ARG 177 N 2.01 3.15 0.12 1.98 1.81 -1.26 -4.65 118.95 122.12 2hxy s ARG 177 Ca 0.15 -0.71 -0.12 0.00 -1.72 0.00 0.00 55.73 53.33 2hxy s ARG 177 Cb -0.16 -4.25 -0.08 0.00 -0.45 0.00 0.00 34.95 30.01 2hxy s ARG 177 CO 0.10 -1.91 1.42 1.79 -0.68 0.00 0.00 175.30 176.02 2hxy h THR 178 N 6.00 1.28 0.00 0.02 1.35 -1.89 -3.38 112.91 116.29 2hxy h THR 178 Ca -0.27 -1.63 0.00 0.00 -0.55 0.00 0.00 66.41 63.96 2hxy h THR 178 Cb 1.06 1.57 0.00 0.00 -1.73 0.00 0.00 68.15 69.05 2hxy h THR 178 CO 1.21 0.53 0.00 -1.14 -0.25 0.00 0.00 175.52 175.87 2hxy n ARG 179 N -4.08 0.00 -0.43 4.72 0.63 -1.26 0.22 116.66 116.46 2hxy n ARG 179 Ca -0.04 0.00 0.07 0.00 -0.92 0.00 0.00 57.85 56.97 2hxy n ARG 179 Cb 0.58 0.00 0.26 0.00 0.45 0.00 0.00 32.46 33.75 2hxy n ARG 179 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2hxy n ALA 180 N -2.38 2.85 -2.17 5.13 0.00 -1.26 -4.89 120.51 117.79 2hxy n ALA 180 Ca 0.00 -1.13 -0.41 0.00 0.00 0.00 0.00 53.44 51.89 2hxy n ALA 180 Cb 0.00 -1.01 -0.03 0.00 0.00 0.00 0.00 19.45 18.41 2hxy n ALA 180 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2hxy s ILE 181 N -1.67 3.68 -0.02 0.00 1.01 0.58 -4.32 121.20 120.45 2hxy s ILE 181 Ca 0.38 1.32 0.03 0.00 0.00 0.00 0.00 60.65 62.38 2hxy s ILE 181 Cb 0.24 -3.85 0.05 0.00 0.01 0.00 0.00 42.46 38.91 2hxy s ILE 181 CO 0.20 0.17 0.89 2.29 0.00 0.00 0.00 174.94 178.48 2hxy n LYS 182 N 3.05 1.53 -3.60 2.79 2.85 0.13 -4.71 118.16 120.20 2hxy n LYS 182 Ca 0.06 -1.35 -0.02 0.00 -1.05 0.00 0.00 58.31 55.95 2hxy n LYS 182 Cb 0.45 -0.89 -0.05 0.00 -0.65 0.00 0.00 35.03 33.89 2hxy n LYS 182 CO 0.00 0.00 0.00 1.41 -0.05 0.00 0.00 177.40 178.76 2hxy s MET 183 N -0.94 0.53 -0.19 -1.58 0.00 -1.14 -3.49 119.30 112.49 2hxy s MET 183 Ca 0.06 1.17 -0.03 0.00 0.00 0.00 0.00 55.69 56.89 2hxy s MET 183 Cb 0.05 0.52 -0.01 0.00 0.00 0.00 0.00 34.83 35.39 2hxy s MET 183 CO 0.01 -0.15 -0.08 -1.17 0.00 0.00 0.00 175.02 173.62 2hxy s LEU 184 N 2.32 2.80 -0.18 4.11 2.96 0.68 -0.76 118.68 130.62 2hxy s LEU 184 Ca -0.07 -0.39 -0.02 0.00 -0.22 0.00 0.00 54.13 53.44 2hxy s LEU 184 Cb -0.08 -1.69 -0.01 0.00 0.50 0.00 0.00 46.19 44.91 2hxy s LEU 184 CO -0.18 0.03 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.08 2hxy s VAL 185 N 1.16 3.03 -0.75 1.68 1.01 0.16 -1.13 120.40 125.55 2hxy s VAL 185 Ca 0.02 -0.63 -0.05 0.00 0.00 0.00 0.00 61.98 61.31 2hxy s VAL 185 Cb -0.14 -2.32 0.19 0.00 0.00 0.00 0.00 36.38 34.10 2hxy s VAL 185 CO -0.02 0.48 0.61 -0.76 0.00 0.00 0.00 175.10 175.42 2hxy s LEU 186 N 1.00 5.67 0.45 3.92 1.43 -0.69 -0.75 118.68 129.71 2hxy s LEU 186 Ca -0.01 -3.06 -0.22 0.00 -1.03 0.00 0.00 54.13 49.80 2hxy s LEU 186 Cb -0.15 -1.95 -0.08 0.00 0.03 0.00 0.00 46.19 44.04 2hxy s LEU 186 CO -0.01 -0.36 1.10 -0.62 0.23 0.00 0.00 176.35 176.69 2hxy s ASP 187 N 0.80 6.35 -1.70 2.29 -1.08 -0.78 -1.34 116.67 121.21 2hxy s ASP 187 Ca 0.20 2.14 -0.12 0.00 -0.52 0.00 0.00 52.55 54.25 2hxy s ASP 187 Cb -0.15 -2.59 0.12 0.00 -1.46 0.00 0.00 42.92 38.85 2hxy s ASP 187 CO -0.07 -0.78 0.37 -0.62 0.52 0.00 0.00 175.17 174.59 2hxy n GLU 188 N -0.51 -1.24 -0.09 4.34 1.02 -0.85 -4.45 120.64 118.87 2hxy n GLU 188 Ca 0.07 0.16 -0.06 0.00 -0.02 0.00 0.00 57.16 57.31 2hxy n GLU 188 Cb 0.50 -4.30 -0.00 0.00 -0.02 0.00 0.00 31.44 27.62 2hxy n GLU 188 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2hxy h ALA 189 N 0.84 0.23 -1.01 0.62 0.00 -1.33 -0.68 119.26 117.93 2hxy h ALA 189 Ca -0.62 0.12 0.29 0.00 0.00 0.00 0.00 54.91 54.69 2hxy h ALA 189 Cb 1.39 0.22 -0.14 0.00 0.00 0.00 0.00 17.79 19.27 2hxy h ALA 189 CO 0.79 -0.45 0.59 0.38 0.00 0.00 0.00 179.25 180.56 2hxy h ASP 190 N 0.02 0.59 -0.07 0.00 2.03 -1.82 0.24 116.42 117.40 2hxy h ASP 190 Ca 0.15 0.16 -0.03 0.00 -0.73 0.00 0.00 57.03 56.58 2hxy h ASP 190 Cb 0.23 0.08 -0.00 0.00 -0.83 0.00 0.00 39.33 38.81 2hxy h ASP 190 CO -0.31 -0.02 -0.09 -0.08 -1.03 0.00 0.00 179.24 177.71 2hxy h GLU 191 N 0.44 0.18 -1.21 4.15 4.57 -1.51 -2.88 114.58 118.33 2hxy h GLU 191 Ca 0.69 -0.10 0.42 0.00 -1.18 0.00 0.00 59.36 59.19 2hxy h GLU 191 Cb 1.47 0.01 -0.14 0.00 -0.16 0.00 0.00 28.75 29.93 2hxy h GLU 191 CO -0.53 0.64 0.74 0.52 -1.18 0.00 0.00 179.01 179.20 2hxy h MET 192 N -0.28 0.09 -0.05 1.92 2.86 0.36 0.33 114.93 120.17 2hxy h MET 192 Ca 0.01 -0.01 -0.17 0.00 -2.06 0.00 0.00 59.70 57.48 2hxy h MET 192 Cb 0.62 -0.02 0.01 0.00 0.06 0.00 0.00 31.60 32.27 2hxy h MET 192 CO 0.02 0.06 -0.63 -0.07 1.06 0.00 0.00 176.91 177.35 2hxy h LEU 193 N 0.09 0.63 -2.46 1.22 3.38 -1.21 -2.39 115.31 114.58 2hxy h LEU 193 Ca 0.82 -0.71 0.02 0.00 0.09 0.00 0.00 57.88 58.11 2hxy h LEU 193 Cb 2.40 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 42.95 2hxy h LEU 193 CO -0.53 1.25 0.12 0.78 0.09 0.00 0.00 178.44 180.14 2hxy h ASN 194 N 0.07 0.00 -0.65 -0.43 4.21 -0.17 0.83 115.58 119.44 2hxy h ASN 194 Ca -0.06 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.45 2hxy h ASN 194 Cb 1.30 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.50 2hxy h ASN 194 CO 0.13 0.00 0.00 0.29 -1.29 0.00 0.00 177.43 176.56 2hxy n LYS 195 N -3.50 3.16 -3.49 0.81 5.02 -0.72 -4.99 118.16 114.44 2hxy n LYS 195 Ca -0.01 -2.61 -0.21 0.00 -2.02 0.00 0.00 58.31 53.46 2hxy n LYS 195 Cb 0.21 -1.72 0.04 0.00 -0.02 0.00 0.00 35.03 33.53 2hxy n LYS 195 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2hxy n GLY 196 N 1.32 -1.12 0.50 0.72 0.00 0.29 -4.92 105.19 101.99 2hxy n GLY 196 Ca 0.24 0.50 0.05 0.00 0.00 0.00 0.00 46.02 46.81 2hxy n GLY 196 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2hxy n PHE 197 N -3.35 0.25 -0.03 1.61 3.01 -0.91 -4.81 117.46 113.23 2hxy n PHE 197 Ca -0.10 -0.30 -0.01 0.00 1.01 0.00 0.00 57.45 58.05 2hxy n PHE 197 Cb 0.59 -0.02 -0.01 0.00 -0.01 0.00 0.00 39.48 40.04 2hxy n PHE 197 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 2hxy n LYS 198 N 0.46 -0.03 0.09 -1.08 4.81 -1.26 -1.43 118.16 119.71 2hxy n LYS 198 Ca 0.08 0.66 -0.12 0.00 -0.87 0.00 0.00 58.31 58.07 2hxy n LYS 198 Cb 0.34 -0.99 -0.05 0.00 0.02 0.00 0.00 35.03 34.35 2hxy n LYS 198 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 2hxy h GLU 199 N 0.00 -0.39 -0.79 1.64 4.39 -2.00 -2.50 114.58 114.93 2hxy h GLU 199 Ca 0.01 0.03 0.19 0.00 0.34 0.00 0.00 59.36 59.93 2hxy h GLU 199 Cb 0.03 0.09 -0.13 0.00 -0.10 0.00 0.00 28.75 28.64 2hxy h GLU 199 CO -0.07 -0.26 0.15 1.96 -1.16 0.00 0.00 179.01 179.63 2hxy h GLN 200 N -0.40 0.20 0.49 2.33 7.50 -1.60 0.18 115.11 123.80 2hxy h GLN 200 Ca 0.04 -0.01 -0.01 0.00 0.50 0.00 0.00 58.65 59.17 2hxy h GLN 200 Cb 0.45 -0.04 -0.02 0.00 0.05 0.00 0.00 27.48 27.92 2hxy h GLN 200 CO -0.17 0.13 -0.48 0.82 -1.50 0.00 0.00 178.83 177.63 2hxy h ILE 201 N 0.20 0.00 -0.71 2.54 1.08 -0.90 -0.29 117.51 119.43 2hxy h ILE 201 Ca 0.46 0.00 0.15 0.00 -0.39 0.00 0.00 64.86 65.08 2hxy h ILE 201 Cb 0.85 0.00 -0.13 0.00 -3.07 0.00 0.00 36.82 34.47 2hxy h ILE 201 CO -0.60 0.00 -0.13 1.88 -0.69 0.00 0.00 178.15 178.60 2hxy h TYR 202 N -0.97 -0.30 -0.52 1.37 -1.99 -0.55 0.12 116.97 114.14 2hxy h TYR 202 Ca -0.06 0.06 0.07 0.00 2.00 0.00 0.00 58.73 60.80 2hxy h TYR 202 Cb 0.84 0.24 -0.06 0.00 2.00 0.00 0.00 36.73 39.75 2hxy h TYR 202 CO -0.24 -0.29 0.20 -0.44 -0.00 0.00 0.00 178.16 177.39 2hxy h ASP 203 N 0.02 0.22 -0.32 3.88 3.45 -0.30 -1.92 116.42 121.45 2hxy h ASP 203 Ca 0.35 0.06 -0.02 0.00 0.43 0.00 0.00 57.03 57.85 2hxy h ASP 203 Cb 0.56 0.03 -0.02 0.00 -0.56 0.00 0.00 39.33 39.34 2hxy h ASP 203 CO -0.71 0.15 0.13 0.58 -1.57 0.00 0.00 179.24 177.83 2hxy h VAL 204 N 0.39 1.16 -0.25 -1.35 2.07 0.10 -1.96 116.25 116.41 2hxy h VAL 204 Ca 0.25 -0.52 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 2hxy h VAL 204 Cb 0.25 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 2hxy h VAL 204 CO -0.24 0.20 0.13 0.22 0.02 0.00 0.00 177.57 177.90 2hxy h TYR 205 N 0.54 0.34 -0.58 1.57 3.20 -0.53 -2.83 116.97 118.67 2hxy h TYR 205 Ca 0.13 -0.01 0.12 0.00 3.14 0.00 0.00 58.73 62.11 2hxy h TYR 205 Cb 0.15 -0.11 -0.10 0.00 1.54 0.00 0.00 36.73 38.21 2hxy h TYR 205 CO 0.01 0.29 -0.05 0.00 -1.64 0.00 0.00 178.16 176.77 2hxy h ARG 206 N 0.29 0.07 0.00 1.82 3.08 -0.97 0.20 114.38 118.87 2hxy h ARG 206 Ca 0.09 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 2hxy h ARG 206 Cb 0.07 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.10 2hxy h ARG 206 CO -0.01 0.05 0.00 0.66 -1.07 0.00 0.00 179.97 179.59 2hxy n TYR 207 N -5.31 0.71 -0.95 3.04 4.01 -1.09 -4.68 117.16 112.89 2hxy n TYR 207 Ca 0.08 0.29 -0.11 0.00 -0.16 0.00 0.00 57.90 57.99 2hxy n TYR 207 Cb 0.33 -0.96 0.09 0.00 -0.31 0.00 0.00 39.34 38.49 2hxy n TYR 207 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2hxy n LEU 208 N -2.15 0.00 -4.94 7.72 4.77 0.70 -4.80 117.00 118.30 2hxy n LEU 208 Ca 0.02 -0.48 -0.20 0.00 -0.03 0.00 0.00 56.01 55.32 2hxy n LEU 208 Cb 0.21 -0.38 -0.02 0.00 -2.33 0.00 0.00 43.42 40.90 2hxy n LEU 208 CO 0.18 -1.23 -0.00 -2.84 -1.33 0.00 0.00 177.39 172.17 2hxy s PRO 209 N -4.00 3.03 0.24 3.23 0.02 -1.26 -5.04 135.00 131.23 2hxy s PRO 209 Ca 0.28 -1.07 -0.31 0.00 0.02 0.00 0.00 61.00 59.92 2hxy s PRO 209 Cb -0.02 -2.72 -0.12 0.00 0.02 0.00 0.00 34.50 31.66 2hxy s PRO 209 CO 0.20 0.13 1.65 -0.35 -0.33 0.00 0.00 177.00 178.30 2hxy n PRO 210 N -1.52 2.69 -0.55 5.54 -0.04 -1.26 -2.78 135.00 137.08 2hxy n PRO 210 Ca -0.02 0.96 0.00 0.00 -0.04 0.00 0.00 63.50 64.40 2hxy n PRO 210 Cb 0.58 -2.77 0.00 0.00 -0.04 0.00 0.00 33.50 31.27 2hxy n PRO 210 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2hxy n ALA 211 N 3.08 0.00 -1.67 0.55 0.00 -1.26 -5.04 120.51 116.17 2hxy n ALA 211 Ca 0.13 0.00 -0.45 0.00 0.00 0.00 0.00 53.44 53.11 2hxy n ALA 211 Cb 0.35 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.77 2hxy n ALA 211 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2hxy n THR 212 N -2.40 0.51 -2.37 0.00 -1.04 -1.12 -4.96 114.28 102.91 2hxy n THR 212 Ca 0.00 -0.13 -0.42 0.00 -2.04 0.00 0.00 64.05 61.46 2hxy n THR 212 Cb 0.00 -1.51 -0.03 0.00 -1.82 0.00 0.00 70.33 66.97 2hxy n THR 212 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 2hxy s GLN 213 N 0.19 4.40 -0.18 -2.82 0.74 -1.23 -4.91 119.66 115.85 2hxy s GLN 213 Ca 0.73 1.83 0.00 0.00 0.05 0.00 0.00 55.36 57.97 2hxy s GLN 213 Cb -0.66 -3.36 0.04 0.00 1.10 0.00 0.00 33.01 30.13 2hxy s GLN 213 CO 0.44 -0.32 -0.08 0.08 -0.55 0.00 0.00 175.29 174.86 2hxy s VAL 214 N 1.26 1.39 -0.36 1.34 1.01 -1.26 -0.23 120.40 123.55 2hxy s VAL 214 Ca 0.60 -0.82 -0.12 0.00 0.00 0.00 0.00 61.98 61.63 2hxy s VAL 214 Cb -0.30 -1.51 0.01 0.00 0.00 0.00 0.00 36.38 34.57 2hxy s VAL 214 CO 0.29 0.16 0.23 -0.69 0.00 0.00 0.00 175.10 175.08 2hxy s VAL 215 N 1.51 4.96 -0.21 2.92 1.01 -0.29 -2.89 120.40 127.41 2hxy s VAL 215 Ca -0.00 -0.54 -0.09 0.00 0.00 0.00 0.00 61.98 61.35 2hxy s VAL 215 Cb -0.16 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 2hxy s VAL 215 CO -0.08 -0.13 0.11 -0.22 0.00 0.00 0.00 175.10 174.77 2hxy s LEU 216 N 1.65 3.96 -0.13 3.92 0.20 0.11 -1.70 118.68 126.68 2hxy s LEU 216 Ca 0.04 0.09 -0.03 0.00 0.69 0.00 0.00 54.13 54.93 2hxy s LEU 216 Cb -0.18 -2.03 -0.03 0.00 -0.43 0.00 0.00 46.19 43.52 2hxy s LEU 216 CO 0.09 0.12 -0.01 -0.63 -0.29 0.00 0.00 176.35 175.63 2hxy s ILE 217 N 0.70 4.17 -0.29 6.68 -1.09 -0.45 -1.94 121.20 128.98 2hxy s ILE 217 Ca 0.06 -0.28 -0.18 0.00 -2.23 0.00 0.00 60.65 58.01 2hxy s ILE 217 Cb -0.13 -2.80 0.14 0.00 -1.58 0.00 0.00 42.46 38.10 2hxy s ILE 217 CO 0.02 0.54 0.99 -0.55 -1.23 0.00 0.00 174.94 174.70 2hxy s SER 218 N -0.20 -0.50 0.23 3.58 0.15 -0.71 -1.53 113.70 114.73 2hxy s SER 218 Ca 0.05 0.83 -0.08 0.00 0.70 0.00 0.00 55.95 57.45 2hxy s SER 218 Cb -0.13 1.11 0.22 0.00 -1.71 0.00 0.00 66.02 65.52 2hxy s SER 218 CO 0.02 -0.13 1.90 0.00 1.20 0.00 0.00 173.24 176.23 2hxy h ALA 219 N 5.59 1.13 -2.07 5.45 0.00 -1.87 -1.68 119.26 125.81 2hxy h ALA 219 Ca -0.28 -0.06 -0.61 0.00 0.00 0.00 0.00 54.91 53.97 2hxy h ALA 219 Cb 1.19 -0.35 -0.14 0.00 0.00 0.00 0.00 17.79 18.50 2hxy h ALA 219 CO 0.17 0.50 -0.72 0.95 0.00 0.00 0.00 179.25 180.16 2hxy s THR 220 N -6.12 2.31 -0.42 0.00 -4.23 -1.26 -4.56 115.64 101.36 2hxy s THR 220 Ca -0.13 -2.29 0.02 0.00 -1.18 0.00 0.00 61.69 58.11 2hxy s THR 220 Cb 0.17 -2.47 0.15 0.00 1.34 0.00 0.00 72.50 71.68 2hxy s THR 220 CO 0.80 -0.30 0.27 -0.76 -0.54 0.00 0.00 174.62 174.09 2hxy s LEU 221 N -3.55 1.89 0.85 4.79 1.43 -1.26 -4.63 118.68 118.20 2hxy s LEU 221 Ca 0.31 -2.67 -0.11 0.00 -1.03 0.00 0.00 54.13 50.63 2hxy s LEU 221 Cb -0.01 -0.69 0.10 0.00 0.03 0.00 0.00 46.19 45.62 2hxy s LEU 221 CO 0.15 -0.24 1.10 -2.84 0.23 0.00 0.00 176.35 174.75 2hxy s PRO 222 N 0.41 1.61 0.00 1.29 0.02 -1.26 -4.90 135.00 132.17 2hxy s PRO 222 Ca 0.22 1.07 0.05 0.00 0.02 0.00 0.00 61.00 62.36 2hxy s PRO 222 Cb -0.15 -1.83 0.29 0.00 0.02 0.00 0.00 34.50 32.83 2hxy s PRO 222 CO -0.06 -2.07 0.67 0.72 -0.33 0.00 0.00 177.00 175.93 2hxy n HIS 223 N -3.80 0.00 0.00 6.54 8.25 -1.26 -1.96 115.22 122.99 2hxy n HIS 223 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 2hxy n HIS 223 Cb 0.54 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.65 2hxy n HIS 223 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 2hxy n GLU 224 N -0.73 2.70 0.13 -0.41 2.13 -1.26 -4.04 120.64 119.16 2hxy n GLU 224 Ca 0.04 0.00 0.01 0.00 0.66 0.00 0.00 57.16 57.87 2hxy n GLU 224 Cb 0.02 -0.79 0.02 0.00 0.27 0.00 0.00 31.44 30.96 2hxy n GLU 224 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 2hxy h ILE 225 N 0.00 0.97 -0.07 6.31 1.08 -1.75 -2.78 117.51 121.27 2hxy h ILE 225 Ca 0.00 -2.33 -0.18 0.00 -0.39 0.00 0.00 64.86 61.96 2hxy h ILE 225 Cb 0.00 2.45 0.01 0.00 -3.07 0.00 0.00 36.82 36.21 2hxy h ILE 225 CO 0.00 0.54 -0.66 -0.07 -0.69 0.00 0.00 178.15 177.28 2hxy h LEU 226 N 0.00 0.69 -2.17 1.44 3.38 -1.76 0.15 115.31 117.05 2hxy h LEU 226 Ca -0.01 -0.69 0.06 0.00 0.09 0.00 0.00 57.88 57.34 2hxy h LEU 226 Cb 1.41 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 2hxy h LEU 226 CO 0.07 1.28 0.27 -0.08 0.09 0.00 0.00 178.44 180.07 2hxy h GLU 227 N 0.17 0.00 0.06 1.13 4.57 -1.65 -0.92 114.58 117.94 2hxy h GLU 227 Ca -0.06 0.00 -0.31 0.00 -1.18 0.00 0.00 59.36 57.80 2hxy h GLU 227 Cb 1.32 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.88 2hxy h GLU 227 CO 0.13 0.00 -1.72 -0.12 -1.18 0.00 0.00 179.01 176.12 2hxy n MET 228 N -3.65 0.67 0.32 1.92 1.56 -1.04 -3.53 117.12 113.37 2hxy n MET 228 Ca 0.03 0.39 -0.19 0.00 -0.27 0.00 0.00 57.70 57.66 2hxy n MET 228 Cb 0.40 -1.71 -0.10 0.00 2.15 0.00 0.00 33.22 33.96 2hxy n MET 228 CO 0.00 0.00 0.00 1.79 -0.73 0.00 0.00 175.97 177.03 2hxy h THR 229 N -0.43 0.00 0.00 1.12 1.35 0.59 -1.24 112.91 114.30 2hxy h THR 229 Ca -0.41 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 2hxy h THR 229 Cb 1.70 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.12 2hxy h THR 229 CO -0.07 0.00 0.00 -0.46 -0.25 0.00 0.00 175.52 174.74 2hxy n ASN 230 N -5.58 0.60 0.25 5.36 0.23 -0.61 -2.12 115.26 113.39 2hxy n ASN 230 Ca -0.13 0.69 0.15 0.00 -0.53 0.00 0.00 54.58 54.76 2hxy n ASN 230 Cb 0.48 -0.80 0.43 0.00 -2.08 0.00 0.00 39.78 37.81 2hxy n ASN 230 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 2hxy h LYS 231 N 0.00 0.00 -0.30 -3.83 3.64 -1.27 -3.37 116.57 111.43 2hxy h LYS 231 Ca 0.00 0.00 -0.26 0.00 -1.27 0.00 0.00 60.65 59.12 2hxy h LYS 231 Cb 0.24 0.00 -0.22 0.00 -0.41 0.00 0.00 32.23 31.84 2hxy h LYS 231 CO 0.00 0.00 -0.60 1.97 -2.27 0.00 0.00 179.45 178.55 2hxy n PHE 232 N -3.07 -1.46 -3.36 1.91 -0.00 -0.99 -5.07 117.46 105.42 2hxy n PHE 232 Ca 0.02 -2.20 -0.01 0.00 -0.00 0.00 0.00 57.45 55.27 2hxy n PHE 232 Cb 0.41 1.03 -0.04 0.00 -0.00 0.00 0.00 39.48 40.89 2hxy n PHE 232 CO 0.00 0.00 0.00 1.41 -0.00 0.00 0.00 176.76 178.17 2hxy s MET 233 N -0.75 0.50 -0.09 3.97 1.75 -0.90 -4.81 119.30 118.98 2hxy s MET 233 Ca 0.24 1.03 -0.15 0.00 -1.25 0.00 0.00 55.69 55.56 2hxy s MET 233 Cb 0.41 0.41 -0.05 0.00 2.84 0.00 0.00 34.83 38.45 2hxy s MET 233 CO -0.05 -0.48 0.37 0.95 -0.65 0.00 0.00 175.02 175.15 2hxy s THR 234 N 2.78 5.19 -0.39 10.11 -4.23 -1.26 -4.57 115.64 123.27 2hxy s THR 234 Ca 0.11 0.73 -0.17 0.00 -1.18 0.00 0.00 61.69 61.17 2hxy s THR 234 Cb -0.14 -3.69 0.03 0.00 1.34 0.00 0.00 72.50 70.03 2hxy s THR 234 CO -0.19 0.46 0.44 -0.67 -0.54 0.00 0.00 174.62 174.12 2hxy n ASP 235 N 2.88 -3.53 -4.89 3.99 4.64 -1.26 -4.64 116.55 113.74 2hxy n ASP 235 Ca -0.12 -0.31 -0.29 0.00 -1.38 0.00 0.00 54.79 52.69 2hxy n ASP 235 Cb 0.52 -1.07 -0.01 0.00 -1.04 0.00 0.00 41.12 39.52 2hxy n ASP 235 CO 0.00 0.00 0.00 -2.16 -0.82 0.00 0.00 177.20 174.22 2hxy s PRO 236 N -2.49 3.62 -0.17 -0.67 0.04 -1.26 -4.53 135.00 129.53 2hxy s PRO 236 Ca 0.17 0.43 -0.16 0.00 0.04 0.00 0.00 61.00 61.48 2hxy s PRO 236 Cb -0.02 -2.29 -0.04 0.00 0.04 0.00 0.00 34.50 32.19 2hxy s PRO 236 CO 0.60 -0.27 0.38 0.42 0.04 0.00 0.00 177.00 178.17 2hxy s ILE 237 N -2.78 5.23 -0.18 0.56 -1.09 0.15 -4.97 121.20 118.13 2hxy s ILE 237 Ca 0.51 0.70 -0.07 0.00 -2.23 0.00 0.00 60.65 59.56 2hxy s ILE 237 Cb -0.10 -3.71 -0.04 0.00 -1.58 0.00 0.00 42.46 37.02 2hxy s ILE 237 CO 0.44 0.31 0.05 -0.13 -1.23 0.00 0.00 174.94 174.37 2hxy s ARG 238 N 0.92 3.91 -0.41 2.79 0.52 -1.26 -0.75 118.95 124.67 2hxy s ARG 238 Ca 0.19 -0.37 0.04 0.00 -0.52 0.00 0.00 55.73 55.08 2hxy s ARG 238 Cb -0.14 -3.16 0.11 0.00 0.52 0.00 0.00 34.95 32.28 2hxy s ARG 238 CO 0.07 0.29 0.13 0.42 0.02 0.00 0.00 175.30 176.22 2hxy s ILE 239 N 0.32 2.39 0.46 1.52 1.01 0.22 -4.95 121.20 122.17 2hxy s ILE 239 Ca 0.02 -2.71 0.06 0.00 0.00 0.00 0.00 60.65 58.03 2hxy s ILE 239 Cb -0.13 -2.73 0.06 0.00 0.01 0.00 0.00 42.46 39.68 2hxy s ILE 239 CO 0.01 -0.67 0.52 0.18 0.00 0.00 0.00 174.94 174.97 2hxy n LEU 240 N 3.83 0.00 -0.12 2.97 4.77 -1.26 -1.56 117.00 125.63 2hxy n LEU 240 Ca 0.04 -2.17 -0.22 0.00 -0.03 0.00 0.00 56.01 53.64 2hxy n LEU 240 Cb 0.38 -0.21 -0.12 0.00 -2.33 0.00 0.00 43.42 41.14 2hxy n LEU 240 CO 0.26 -0.61 -1.29 0.52 -1.33 0.00 0.00 177.39 174.94 2hxy n VAL 241 N -1.83 1.53 -3.52 4.08 0.31 -1.26 -4.92 118.33 112.73 2hxy n VAL 241 Ca 0.07 -0.50 -0.37 0.00 -0.01 0.00 0.00 64.34 63.52 2hxy n VAL 241 Cb 0.50 -1.60 -0.06 0.00 -0.91 0.00 0.00 33.84 31.76 2hxy n VAL 241 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2hxy s LYS 242 N -2.51 3.89 0.77 5.55 1.02 -1.26 -5.04 119.74 122.15 2hxy s LYS 242 Ca -0.35 0.37 -0.15 0.00 0.02 0.00 0.00 55.97 55.86 2hxy s LYS 242 Cb 0.10 -3.18 -0.02 0.00 -0.52 0.00 0.00 37.83 34.22 2hxy s LYS 242 CO 0.59 0.67 0.57 -2.13 -0.92 0.00 0.00 175.35 174.12 2hxy n ARG 243 N 1.65 0.19 -3.74 1.68 0.63 -1.26 -4.99 116.66 110.83 2hxy n ARG 243 Ca -0.13 0.11 -0.13 0.00 -0.92 0.00 0.00 57.85 56.78 2hxy n ARG 243 Cb 0.52 -1.89 -0.13 0.00 0.45 0.00 0.00 32.46 31.41 2hxy n ARG 243 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 2hxy s ASP 244 N -1.62 -0.20 0.04 6.15 -1.08 -1.26 -5.16 116.67 113.55 2hxy s ASP 244 Ca 0.65 0.43 0.05 0.00 -0.52 0.00 0.00 52.55 53.16 2hxy s ASP 244 Cb -0.32 0.33 -0.02 0.00 -1.46 0.00 0.00 42.92 41.44 2hxy s ASP 244 CO 0.59 -0.15 -0.16 -1.83 0.52 0.00 0.00 175.17 174.14 2hxy s GLU 245 N 1.12 1.01 0.34 4.34 -1.05 -1.26 -5.09 118.70 118.11 2hxy s GLU 245 Ca -0.08 -0.82 -0.28 0.00 -0.15 0.00 0.00 54.97 53.64 2hxy s GLU 245 Cb -0.10 -1.05 -0.12 0.00 -0.44 0.00 0.00 34.13 32.41 2hxy s GLU 245 CO -0.07 0.26 1.25 1.28 0.95 0.00 0.00 175.26 178.93 2hxy n LEU 246 N 1.82 3.32 -3.64 1.83 4.32 -1.26 -4.66 117.00 118.73 2hxy n LEU 246 Ca -0.18 1.20 -0.09 0.00 -0.02 0.00 0.00 56.01 56.92 2hxy n LEU 246 Cb 0.54 -1.46 -0.07 0.00 -1.62 0.00 0.00 43.42 40.82 2hxy n LEU 246 CO 0.23 -0.63 0.41 0.42 -1.22 0.00 0.00 177.39 176.60 2hxy s THR 247 N -1.10 0.00 -0.51 -5.08 -4.23 -1.10 -4.94 115.64 98.68 2hxy s THR 247 Ca 0.56 0.00 0.03 0.00 -1.18 0.00 0.00 61.69 61.10 2hxy s THR 247 Cb -0.58 -1.00 0.22 0.00 1.34 0.00 0.00 72.50 72.47 2hxy s THR 247 CO 0.62 0.00 1.02 0.00 -0.54 0.00 0.00 174.62 175.72 2hxy n LEU 248 N 3.73 3.06 -4.75 4.79 -0.00 -1.26 -3.65 117.00 118.92 2hxy n LEU 248 Ca -0.18 -1.56 -0.41 0.00 -0.00 0.00 0.00 56.01 53.86 2hxy n LEU 248 Cb 0.58 -0.57 -0.02 0.00 -0.00 0.00 0.00 43.42 43.41 2hxy n LEU 248 CO -0.00 0.48 1.14 -0.70 -0.00 0.00 0.00 177.39 178.31 2hxy s GLU 249 N -1.27 4.22 0.00 1.47 -6.30 -1.26 -2.01 118.70 113.55 2hxy s GLU 249 Ca 0.16 2.40 0.00 0.00 -2.50 0.00 0.00 54.97 55.03 2hxy s GLU 249 Cb 0.13 -3.07 0.00 0.00 0.00 0.00 0.00 34.13 31.19 2hxy s GLU 249 CO 0.04 -0.47 0.00 0.41 0.02 0.00 0.00 175.26 175.26 2hxy n GLY 250 N 1.88 1.89 3.71 -1.50 0.00 -1.26 -4.91 105.19 104.99 2hxy n GLY 250 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 2hxy n GLY 250 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2hxy s ILE 251 N -2.36 5.33 -0.24 -0.61 1.01 -0.85 -3.59 121.20 119.89 2hxy s ILE 251 Ca 0.00 0.41 -0.27 0.00 0.00 0.00 0.00 60.65 60.78 2hxy s ILE 251 Cb 0.00 -3.58 0.01 0.00 0.01 0.00 0.00 42.46 38.90 2hxy s ILE 251 CO 0.00 0.38 0.97 -0.54 0.00 0.00 0.00 174.94 175.75 2hxy s LYS 252 N 0.65 4.22 -0.11 2.79 -0.14 -1.16 -4.97 119.74 121.01 2hxy s LYS 252 Ca 0.13 1.19 0.00 0.00 -1.36 0.00 0.00 55.97 55.93 2hxy s LYS 252 Cb -0.13 -3.65 -0.02 0.00 -1.68 0.00 0.00 37.83 32.35 2hxy s LYS 252 CO 0.03 -0.61 -0.11 -0.65 -0.76 0.00 0.00 175.35 173.25 2hxy s GLN 253 N 3.10 3.18 0.21 1.68 -0.21 -1.26 -0.80 119.66 125.56 2hxy s GLN 253 Ca 0.41 -0.64 -0.00 0.00 0.02 0.00 0.00 55.36 55.15 2hxy s GLN 253 Cb -0.15 -2.63 -0.04 0.00 1.00 0.00 0.00 33.01 31.19 2hxy s GLN 253 CO 0.07 0.36 0.13 -0.06 -2.12 0.00 0.00 175.29 173.67 2hxy s PHE 254 N -0.02 1.25 -0.03 0.91 2.99 -0.30 -2.69 117.98 120.08 2hxy s PHE 254 Ca -0.02 -1.35 -0.04 0.00 0.00 0.00 0.00 56.93 55.51 2hxy s PHE 254 Cb -0.14 -0.63 0.01 0.00 0.00 0.00 0.00 43.02 42.26 2hxy s PHE 254 CO 0.04 -0.59 0.11 -0.59 -0.00 0.00 0.00 175.22 174.18 2hxy s PHE 255 N -4.07 -0.05 -0.27 0.36 -0.12 -0.09 0.17 117.98 113.91 2hxy s PHE 255 Ca 0.39 0.13 -0.05 0.00 -0.05 0.00 0.00 56.93 57.35 2hxy s PHE 255 Cb 0.07 0.00 0.01 0.00 -0.63 0.00 0.00 43.02 42.47 2hxy s PHE 255 CO 0.13 -0.12 0.02 0.08 -0.05 0.00 0.00 175.22 175.28 2hxy s VAL 256 N -0.40 3.56 -1.16 -2.49 1.01 0.03 -2.26 120.40 118.69 2hxy s VAL 256 Ca -0.05 -0.78 -0.21 0.00 0.00 0.00 0.00 61.98 60.94 2hxy s VAL 256 Cb -0.03 -2.81 -0.07 0.00 0.00 0.00 0.00 36.38 33.47 2hxy s VAL 256 CO 0.00 0.15 1.91 0.00 0.00 0.00 0.00 175.10 177.16 2hxy n ALA 257 N 4.79 2.45 -1.12 5.51 0.00 -1.26 -3.24 120.51 127.64 2hxy n ALA 257 Ca -0.15 -3.24 -0.07 0.00 0.00 0.00 0.00 53.44 49.98 2hxy n ALA 257 Cb 0.48 -3.53 0.08 0.00 0.00 0.00 0.00 19.45 16.48 2hxy n ALA 257 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2hxy n VAL 258 N 7.22 0.00 0.00 0.00 0.24 -1.20 -5.04 118.33 119.55 2hxy n VAL 258 Ca 0.47 -0.22 0.00 0.00 -2.04 0.00 0.00 64.34 62.54 2hxy n VAL 258 Cb 0.45 -1.34 0.00 0.00 -1.47 0.00 0.00 33.84 31.49 2hxy n VAL 258 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2hxy n GLU 259 N -2.41 0.00 -4.28 7.34 1.02 -1.26 -4.58 120.64 116.46 2hxy n GLU 259 Ca 0.05 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 57.04 2hxy n GLU 259 Cb 0.20 -0.46 -0.10 0.00 -0.02 0.00 0.00 31.44 31.06 2hxy n GLU 259 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 2hxy s ARG 260 N -2.00 1.20 0.25 3.49 1.70 -1.26 -2.76 118.95 119.57 2hxy s ARG 260 Ca 0.00 -1.57 -0.03 0.00 -0.47 0.00 0.00 55.73 53.65 2hxy s ARG 260 Cb 0.00 -0.53 0.46 0.00 -0.57 0.00 0.00 34.95 34.31 2hxy s ARG 260 CO 0.00 -0.05 1.77 0.93 -1.08 0.00 0.00 175.30 176.86 2hxy h GLU 261 N 2.62 0.60 0.00 3.89 4.39 -2.01 -2.31 114.58 121.76 2hxy h GLU 261 Ca -0.37 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.29 2hxy h GLU 261 Cb 1.21 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.72 2hxy h GLU 261 CO 0.64 0.39 0.00 0.93 -1.16 0.00 0.00 179.01 179.81 2hxy h GLU 262 N 0.61 0.00 0.00 2.33 3.07 -2.04 0.64 114.58 119.19 2hxy h GLU 262 Ca 0.42 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.28 2hxy h GLU 262 Cb 0.55 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.46 2hxy h GLU 262 CO -0.33 0.00 -0.53 -1.49 -1.40 0.00 0.00 179.01 175.26 2hxy h TRP 263 N 0.00 0.00 0.45 4.33 4.06 -1.85 -3.36 115.95 119.57 2hxy h TRP 263 Ca 0.00 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 2hxy h TRP 263 Cb 0.28 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.43 2hxy h TRP 263 CO 0.00 0.00 -0.30 0.87 -3.56 0.00 0.00 178.44 175.45 2hxy h LYS 264 N 0.00 -0.69 -0.43 0.49 1.57 -0.88 -2.89 116.57 113.74 2hxy h LYS 264 Ca 0.00 0.05 0.04 0.00 -1.87 0.00 0.00 60.65 58.87 2hxy h LYS 264 Cb 0.75 0.16 -0.06 0.00 0.08 0.00 0.00 32.23 33.16 2hxy h LYS 264 CO 0.00 -0.46 -0.33 0.35 -0.57 0.00 0.00 179.45 178.44 2hxy h PHE 265 N -0.72 -1.03 -0.68 -1.35 3.57 -1.72 0.12 116.94 115.13 2hxy h PHE 265 Ca -0.05 0.06 0.15 0.00 3.53 0.00 0.00 57.97 61.66 2hxy h PHE 265 Cb 0.60 0.51 -0.12 0.00 2.79 0.00 0.00 35.95 39.72 2hxy h PHE 265 CO -0.11 -0.24 -0.05 -0.44 -2.23 0.00 0.00 178.31 175.24 2hxy h ASP 266 N -0.09 -0.41 -0.49 0.41 3.32 -1.78 0.41 116.42 117.79 2hxy h ASP 266 Ca 0.07 0.18 0.12 0.00 0.02 0.00 0.00 57.03 57.42 2hxy h ASP 266 Cb 0.28 0.34 -0.02 0.00 0.22 0.00 0.00 39.33 40.14 2hxy h ASP 266 CO -0.45 -0.17 0.34 0.74 -1.72 0.00 0.00 179.24 177.98 2hxy h THR 267 N 0.07 0.81 0.26 0.35 2.02 -0.63 -0.15 112.91 115.65 2hxy h THR 267 Ca 0.36 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.48 2hxy h THR 267 Cb 0.59 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 67.68 2hxy h THR 267 CO -0.63 0.02 -0.13 0.25 0.37 0.00 0.00 175.52 175.41 2hxy h LEU 268 N 0.12 -0.30 -0.14 2.58 5.85 0.16 -2.95 115.31 120.63 2hxy h LEU 268 Ca 0.23 -0.21 0.03 0.00 0.84 0.00 0.00 57.88 58.77 2hxy h LEU 268 Cb 0.76 0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.80 2hxy h LEU 268 CO -0.03 0.18 -0.53 0.00 -0.34 0.00 0.00 178.44 177.73 2hxy h ASP 270 N -0.57 -0.85 0.20 0.00 3.32 -1.14 0.26 116.42 117.64 2hxy h ASP 270 Ca 0.04 0.29 -0.23 0.00 0.02 0.00 0.00 57.03 57.15 2hxy h ASP 270 Cb 0.67 0.59 0.01 0.00 0.22 0.00 0.00 39.33 40.82 2hxy h ASP 270 CO -0.44 -0.33 -0.92 0.25 -1.72 0.00 0.00 179.24 176.08 2hxy h LEU 271 N 0.00 0.66 -0.78 1.55 5.85 -1.02 -3.23 115.31 118.33 2hxy h LEU 271 Ca 0.49 -0.50 0.32 0.00 0.84 0.00 0.00 57.88 59.03 2hxy h LEU 271 Cb 0.79 -0.20 -0.13 0.00 0.37 0.00 0.00 40.66 41.49 2hxy h LEU 271 CO -1.00 1.30 0.44 0.00 -0.34 0.00 0.00 178.44 178.83 2hxy n TYR 272 N -3.80 0.83 -0.04 1.25 9.36 0.44 -2.03 117.16 123.17 2hxy n TYR 272 Ca -0.07 0.84 -0.01 0.00 3.32 0.00 0.00 57.90 61.97 2hxy n TYR 272 Cb 0.82 -1.26 -0.01 0.00 -0.63 0.00 0.00 39.34 38.26 2hxy n TYR 272 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 2hxy n ASP 273 N -4.62 -0.10 -1.24 2.98 8.00 -1.18 0.13 116.55 120.51 2hxy n ASP 273 Ca 0.29 0.80 -0.04 0.00 0.71 0.00 0.00 54.79 56.55 2hxy n ASP 273 Cb 0.99 -0.34 0.10 0.00 -0.02 0.00 0.00 41.12 41.85 2hxy n ASP 273 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2hxy n THR 274 N -3.01 1.42 -0.02 -3.53 -2.24 -0.86 -4.24 114.28 101.80 2hxy n THR 274 Ca 0.00 -0.60 -0.02 0.00 -2.27 0.00 0.00 64.05 61.16 2hxy n THR 274 Cb 0.02 -0.64 -0.01 0.00 -2.10 0.00 0.00 70.33 67.61 2hxy n THR 274 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 2hxy n LEU 275 N 0.05 0.52 0.13 3.22 0.00 0.35 -4.39 117.00 116.88 2hxy n LEU 275 Ca 0.16 0.14 0.04 0.00 0.00 0.00 0.00 56.01 56.36 2hxy n LEU 275 Cb 0.77 -0.57 0.23 0.00 0.00 0.00 0.00 43.42 43.84 2hxy n LEU 275 CO 0.17 -0.45 0.73 0.35 0.00 0.00 0.00 177.39 178.19 2hxy n THR 276 N -3.01 0.59 -0.46 1.96 -2.24 -1.17 -0.25 114.28 109.69 2hxy n THR 276 Ca -0.03 0.69 0.39 0.00 -2.27 0.00 0.00 64.05 62.83 2hxy n THR 276 Cb 0.13 -1.69 0.67 0.00 -2.10 0.00 0.00 70.33 67.33 2hxy n THR 276 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 2hxy h ILE 277 N 0.00 0.05 -4.27 2.28 2.04 -1.78 -3.37 117.51 112.46 2hxy h ILE 277 Ca 0.00 -0.01 -0.46 0.00 1.00 0.00 0.00 64.86 65.39 2hxy h ILE 277 Cb 0.72 0.01 -0.13 0.00 -0.74 0.00 0.00 36.82 36.68 2hxy h ILE 277 CO 0.00 0.01 -0.52 0.28 0.00 0.00 0.00 178.15 177.92 2hxy s THR 278 N -5.28 0.16 0.37 -0.27 -1.32 0.65 -5.15 115.64 104.81 2hxy s THR 278 Ca -0.08 -2.00 -0.06 0.00 -1.21 0.00 0.00 61.69 58.34 2hxy s THR 278 Cb 0.31 -2.47 0.09 0.00 -1.51 0.00 0.00 72.50 68.92 2hxy s THR 278 CO 0.82 0.00 0.43 0.00 -2.21 0.00 0.00 174.62 173.67 2hxy n GLN 279 N -0.65 -0.94 -3.60 7.08 6.02 -1.26 -4.86 117.38 119.17 2hxy n GLN 279 Ca 0.03 -0.67 -0.09 0.00 -0.01 0.00 0.00 57.00 56.26 2hxy n GLN 279 Cb 0.63 -0.51 -0.06 0.00 1.02 0.00 0.00 30.24 31.33 2hxy n GLN 279 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2hxy s ALA 280 N -3.62 -1.98 -0.15 -1.58 0.00 -0.95 -4.28 121.76 109.20 2hxy s ALA 280 Ca 0.26 1.69 0.00 0.00 0.00 0.00 0.00 51.96 53.91 2hxy s ALA 280 Cb -0.01 -1.03 -0.01 0.00 0.00 0.00 0.00 23.12 22.07 2hxy s ALA 280 CO 0.19 -0.27 -0.14 0.08 0.00 0.00 0.00 175.76 175.61 2hxy s VAL 281 N -0.72 2.84 -0.16 0.00 1.01 -0.66 -0.12 120.40 122.60 2hxy s VAL 281 Ca 0.01 -0.72 -0.02 0.00 0.00 0.00 0.00 61.98 61.25 2hxy s VAL 281 Cb -0.02 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.15 2hxy s VAL 281 CO -0.02 0.52 -0.09 -0.63 0.00 0.00 0.00 175.10 174.87 2hxy s ILE 282 N 0.64 3.25 0.00 2.22 1.01 0.28 -1.52 121.20 127.08 2hxy s ILE 282 Ca -0.08 -0.57 -0.01 0.00 0.00 0.00 0.00 60.65 59.99 2hxy s ILE 282 Cb -0.16 -2.41 -0.04 0.00 0.01 0.00 0.00 42.46 39.87 2hxy s ILE 282 CO 0.03 0.49 0.14 -0.36 0.00 0.00 0.00 174.94 175.24 2hxy s PHE 283 N 0.66 3.42 0.19 3.97 0.40 -0.31 -0.88 117.98 125.43 2hxy s PHE 283 Ca -0.05 0.27 0.01 0.00 -0.60 0.00 0.00 56.93 56.56 2hxy s PHE 283 Cb -0.15 -1.77 -0.05 0.00 0.51 0.00 0.00 43.02 41.56 2hxy s PHE 283 CO 0.02 0.60 0.06 0.00 0.70 0.00 0.00 175.22 176.60 2hxy n ASN 285 N -0.26 0.20 -4.13 0.00 4.13 -1.26 -4.01 115.26 109.92 2hxy n ASN 285 Ca -0.04 0.08 -0.13 0.00 1.68 0.00 0.00 54.58 56.17 2hxy n ASN 285 Cb 0.64 1.60 -0.11 0.00 -1.54 0.00 0.00 39.78 40.37 2hxy n ASN 285 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 2hxy s THR 286 N -3.44 0.73 0.04 3.41 -4.23 -1.26 -4.93 115.64 105.96 2hxy s THR 286 Ca -0.06 -1.52 -0.16 0.00 -1.18 0.00 0.00 61.69 58.77 2hxy s THR 286 Cb 0.13 -1.18 -0.07 0.00 1.34 0.00 0.00 72.50 72.71 2hxy s THR 286 CO 0.88 -0.58 1.25 0.50 -0.54 0.00 0.00 174.62 176.13 2hxy h LYS 287 N 3.74 -0.41 -1.22 3.99 3.64 -1.98 -1.38 116.57 122.94 2hxy h LYS 287 Ca -0.36 0.03 0.35 0.00 -1.27 0.00 0.00 60.65 59.40 2hxy h LYS 287 Cb 1.19 0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 33.05 2hxy h LYS 287 CO 0.52 -0.28 0.96 0.07 -2.27 0.00 0.00 179.45 178.45 2hxy h ARG 288 N -0.43 0.00 0.00 1.90 0.11 -1.99 0.27 114.38 114.24 2hxy h ARG 288 Ca -0.02 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 60.02 2hxy h ARG 288 Cb 0.38 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.46 2hxy h ARG 288 CO -0.05 0.00 -0.31 -0.22 0.10 0.00 0.00 179.97 179.49 2hxy h LYS 289 N 0.00 0.00 0.00 0.08 3.64 -1.69 -0.39 116.57 118.21 2hxy h LYS 289 Ca 0.58 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.95 2hxy h LYS 289 Cb 2.50 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 34.31 2hxy h LYS 289 CO -0.01 0.17 -0.10 0.28 -2.27 0.00 0.00 179.45 177.52 2hxy h VAL 290 N 0.00 0.37 -0.79 2.00 2.07 0.12 -2.50 116.25 117.52 2hxy h VAL 290 Ca -0.01 -1.29 0.14 0.00 0.82 0.00 0.00 66.70 66.36 2hxy h VAL 290 Cb 1.14 0.71 -0.14 0.00 -1.52 0.00 0.00 31.29 31.48 2hxy h VAL 290 CO 0.02 0.12 -0.32 0.44 0.02 0.00 0.00 177.57 177.86 2hxy h ASP 291 N -1.00 -1.14 0.57 0.57 3.45 -1.43 0.58 116.42 118.02 2hxy h ASP 291 Ca -0.01 0.26 -0.02 0.00 0.43 0.00 0.00 57.03 57.69 2hxy h ASP 291 Cb 0.29 0.62 -0.02 0.00 -0.56 0.00 0.00 39.33 39.66 2hxy h ASP 291 CO -0.01 -0.29 -0.49 -0.25 -1.57 0.00 0.00 179.24 176.64 2hxy h TRP 292 N -0.06 -1.33 -0.89 4.55 7.01 -1.16 -1.34 115.95 122.72 2hxy h TRP 292 Ca 0.32 0.00 0.18 0.00 2.11 0.00 0.00 58.89 61.50 2hxy h TRP 292 Cb 0.58 0.51 -0.11 0.00 -2.10 0.00 0.00 29.16 28.04 2hxy h TRP 292 CO -0.72 -0.67 0.45 1.25 -2.79 0.00 0.00 178.44 175.97 2hxy h LEU 293 N -1.03 0.51 0.26 0.65 5.85 -0.47 0.17 115.31 121.25 2hxy h LEU 293 Ca -0.07 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 2hxy h LEU 293 Cb 0.87 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.95 2hxy h LEU 293 CO -0.01 0.15 -0.14 0.74 -0.34 0.00 0.00 178.44 178.84 2hxy h THR 294 N 0.57 0.00 -0.72 1.05 2.02 0.41 -0.31 112.91 115.93 2hxy h THR 294 Ca 0.52 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.84 2hxy h THR 294 Cb 0.85 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 67.12 2hxy h THR 294 CO -0.43 0.00 -0.18 -0.08 0.37 0.00 0.00 175.52 175.20 2hxy h GLU 295 N -0.37 -0.00 0.00 6.66 4.81 -0.77 0.39 114.58 125.29 2hxy h GLU 295 Ca -0.04 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2hxy h GLU 295 Cb 0.29 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 2hxy h GLU 295 CO 0.05 -0.00 -0.02 -0.22 -0.73 0.00 0.00 179.01 178.09 2hxy h LYS 296 N -0.00 0.00 0.00 1.92 1.63 -0.57 0.14 116.57 119.68 2hxy h LYS 296 Ca 0.34 0.00 -0.24 0.00 -0.85 0.00 0.00 60.65 59.90 2hxy h LYS 296 Cb 0.53 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.11 2hxy h LYS 296 CO -0.74 0.02 -1.79 -1.33 -3.45 0.00 0.00 179.45 172.16 2hxy n MET 297 N -3.35 0.64 0.08 1.90 2.81 0.11 -4.04 117.12 115.27 2hxy n MET 297 Ca -0.02 0.15 -0.03 0.00 -1.81 0.00 0.00 57.70 55.99 2hxy n MET 297 Cb 0.14 -1.71 -0.07 0.00 -0.71 0.00 0.00 33.22 30.87 2hxy n MET 297 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2hxy h ARG 298 N 0.00 0.00 0.00 0.03 3.08 -0.14 -0.99 114.38 116.36 2hxy h ARG 298 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.77 2hxy h ARG 298 Cb 1.83 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.88 2hxy h ARG 298 CO 0.05 0.70 0.00 -0.85 -1.07 0.00 0.00 179.97 178.80 2hxy n GLU 299 N -3.23 0.21 0.00 0.04 0.28 0.42 -2.02 120.64 116.34 2hxy n GLU 299 Ca -0.02 0.09 0.04 0.00 -0.16 0.00 0.00 57.16 57.11 2hxy n GLU 299 Cb 0.87 -1.50 -0.02 0.00 1.43 0.00 0.00 31.44 32.23 2hxy n GLU 299 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2hxy n ALA 300 N -1.36 2.80 -1.65 -1.84 0.00 -1.16 -5.09 120.51 112.21 2hxy n ALA 300 Ca 0.09 -0.33 -0.01 0.00 0.00 0.00 0.00 53.44 53.19 2hxy n ALA 300 Cb 0.21 -0.27 -0.01 0.00 0.00 0.00 0.00 19.45 19.38 2hxy n ALA 300 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2hxy n ASN 301 N -0.61 -1.96 -3.55 0.00 4.05 -0.38 -5.06 115.26 107.74 2hxy n ASN 301 Ca 0.03 0.18 -0.17 0.00 0.45 0.00 0.00 54.58 55.06 2hxy n ASN 301 Cb 0.15 -1.56 -0.06 0.00 1.23 0.00 0.00 39.78 39.53 2hxy n ASN 301 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 2hxy s PHE 302 N -0.11 -0.64 -0.72 1.20 0.08 -1.17 -4.94 117.98 111.68 2hxy s PHE 302 Ca -0.03 1.15 -0.15 0.00 0.12 0.00 0.00 56.93 58.02 2hxy s PHE 302 Cb 0.00 0.37 0.18 0.00 -0.57 0.00 0.00 43.02 43.00 2hxy s PHE 302 CO 0.10 -0.56 0.69 -0.08 -0.10 0.00 0.00 175.22 175.27 2hxy s THR 303 N -1.01 5.38 0.38 0.64 -1.32 -1.26 -4.69 115.64 113.75 2hxy s THR 303 Ca -0.10 -1.99 0.08 0.00 -1.21 0.00 0.00 61.69 58.47 2hxy s THR 303 Cb -0.01 -4.44 -0.07 0.00 -1.51 0.00 0.00 72.50 66.46 2hxy s THR 303 CO 0.08 -1.01 -0.03 0.68 -2.21 0.00 0.00 174.62 172.13 2hxy s VAL 304 N 0.96 2.12 -0.07 5.08 -7.23 -1.26 -0.40 120.40 119.59 2hxy s VAL 304 Ca 0.13 -2.09 -0.00 0.00 -1.81 0.00 0.00 61.98 58.21 2hxy s VAL 304 Cb -0.18 -2.84 0.02 0.00 0.56 0.00 0.00 36.38 33.94 2hxy s VAL 304 CO -0.04 -0.09 -0.04 -0.44 -0.31 0.00 0.00 175.10 174.18 2hxy s SER 305 N -3.67 1.53 0.04 4.85 0.01 -0.81 -4.97 113.70 110.69 2hxy s SER 305 Ca 0.34 -0.16 0.07 0.00 1.31 0.00 0.00 55.95 57.52 2hxy s SER 305 Cb 0.07 -0.56 -0.02 0.00 0.21 0.00 0.00 66.02 65.72 2hxy s SER 305 CO 0.17 -0.12 -0.22 -0.94 0.41 0.00 0.00 173.24 172.55 2hxy s SER 306 N 1.51 2.57 0.05 2.44 1.04 -1.26 -1.95 113.70 118.11 2hxy s SER 306 Ca -0.01 -0.52 -0.15 0.00 0.48 0.00 0.00 55.95 55.75 2hxy s SER 306 Cb -0.13 -0.23 0.03 0.00 0.10 0.00 0.00 66.02 65.79 2hxy s SER 306 CO -0.04 0.19 0.34 0.00 0.98 0.00 0.00 173.24 174.71 2hxy s MET 307 N -1.10 0.88 0.00 4.02 0.23 -0.77 -5.00 119.30 117.55 2hxy s MET 307 Ca 0.08 -0.50 0.00 0.00 -1.03 0.00 0.00 55.69 54.24 2hxy s MET 307 Cb -0.09 0.38 0.00 0.00 -1.53 0.00 0.00 34.83 33.59 2hxy s MET 307 CO 0.01 -0.30 0.00 -2.39 -2.03 0.00 0.00 175.02 170.32 2hxy n HIS 308 N 0.43 0.00 0.05 3.16 1.44 -1.26 -2.80 115.22 116.25 2hxy n HIS 308 Ca -0.18 0.00 -0.21 0.00 -2.01 0.00 0.00 57.72 55.32 2hxy n HIS 308 Cb 0.60 0.00 -0.15 0.00 0.12 0.00 0.00 29.99 30.57 2hxy n HIS 308 CO 0.00 0.00 0.00 0.78 -2.81 0.00 0.00 176.34 174.31 2hxy h GLY 309 N 0.00 0.36 -0.90 -1.39 0.00 -1.98 -3.36 103.07 95.79 2hxy h GLY 309 Ca 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 47.33 46.42 2hxy h GLY 309 CO 0.00 0.80 0.00 1.22 0.00 0.00 0.00 176.54 178.56 2hxy n ASP 310 N -4.03 0.00 -4.69 0.19 8.00 -1.26 -4.70 116.55 110.05 2hxy n ASP 310 Ca -0.17 0.00 -0.26 0.00 0.71 0.00 0.00 54.79 55.07 2hxy n ASP 310 Cb 0.87 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.90 2hxy n ASP 310 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2hxy s MET 311 N -0.93 2.50 0.21 -1.24 -1.94 -1.26 -5.11 119.30 111.53 2hxy s MET 311 Ca 0.00 -1.06 -0.30 0.00 -1.71 0.00 0.00 55.69 52.62 2hxy s MET 311 Cb 0.00 -2.41 -0.08 0.00 2.01 0.00 0.00 34.83 34.34 2hxy s MET 311 CO 0.00 0.46 1.02 -1.25 -0.01 0.00 0.00 175.02 175.24 2hxy s PRO 312 N -2.99 4.72 0.46 2.03 0.04 -1.26 -4.88 135.00 133.11 2hxy s PRO 312 Ca 0.28 1.61 0.32 0.00 0.04 0.00 0.00 61.00 63.26 2hxy s PRO 312 Cb -0.09 -3.27 1.44 0.00 0.04 0.00 0.00 34.50 32.62 2hxy s PRO 312 CO 0.20 0.29 1.65 0.37 0.04 0.00 0.00 177.00 179.54 2hxy h GLN 313 N 4.54 0.10 0.00 4.56 5.75 -1.99 0.27 115.11 128.33 2hxy h GLN 313 Ca -0.45 -0.01 -0.10 0.00 -0.15 0.00 0.00 58.65 57.94 2hxy h GLN 313 Cb 1.21 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.72 2hxy h GLN 313 CO 0.69 0.06 -0.49 -0.22 -2.65 0.00 0.00 178.83 176.23 2hxy h LYS 314 N 0.10 0.00 0.15 1.69 3.64 -2.00 -3.25 116.57 116.89 2hxy h LYS 314 Ca 0.79 0.00 -0.32 0.00 -1.27 0.00 0.00 60.65 59.85 2hxy h LYS 314 Cb 2.60 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 34.42 2hxy h LYS 314 CO -0.32 0.49 -1.62 1.49 -2.27 0.00 0.00 179.45 177.22 2hxy h GLU 315 N 0.00 0.31 -0.09 1.90 4.81 -0.93 -3.05 114.58 117.53 2hxy h GLU 315 Ca -0.00 -0.53 0.01 0.00 -0.13 0.00 0.00 59.36 58.71 2hxy h GLU 315 Cb 1.27 0.20 -0.02 0.00 0.63 0.00 0.00 28.75 30.83 2hxy h GLU 315 CO 0.06 1.19 -0.19 0.00 -0.73 0.00 0.00 179.01 179.35 2hxy h ARG 316 N 0.08 -0.16 0.00 1.92 2.47 -1.20 -1.16 114.38 116.34 2hxy h ARG 316 Ca -0.28 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.45 2hxy h ARG 316 Cb 2.05 0.04 0.00 0.00 -1.65 0.00 0.00 29.97 30.41 2hxy h ARG 316 CO 0.17 -0.11 0.00 1.05 0.56 0.00 0.00 179.97 181.64 2hxy h GLU 317 N -0.17 0.00 -0.01 0.04 4.11 -1.74 -2.33 114.58 114.48 2hxy h GLU 317 Ca 0.02 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.38 2hxy h GLU 317 Cb 0.22 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 2hxy h GLU 317 CO -0.17 0.00 -0.30 1.03 0.07 0.00 0.00 179.01 179.64 2hxy h SER 318 N 0.00 0.02 0.02 3.06 0.87 -1.17 0.03 113.55 116.38 2hxy h SER 318 Ca 0.00 -0.01 -0.08 0.00 -1.23 0.00 0.00 61.79 60.48 2hxy h SER 318 Cb 0.52 -0.01 0.01 0.00 -0.44 0.00 0.00 62.40 62.48 2hxy h SER 318 CO 0.00 0.33 -0.31 0.40 -0.53 0.00 0.00 176.83 176.72 2hxy h ILE 319 N 0.02 1.57 -0.08 2.23 1.08 -0.69 -3.21 117.51 118.44 2hxy h ILE 319 Ca 0.00 -2.10 0.02 0.00 -0.39 0.00 0.00 64.86 62.40 2hxy h ILE 319 Cb 0.55 2.92 -0.06 0.00 -3.07 0.00 0.00 36.82 37.16 2hxy h ILE 319 CO 0.04 0.57 -0.51 0.24 -0.69 0.00 0.00 178.15 177.80 2hxy h MET 320 N -0.54 -0.56 -1.33 2.37 2.86 -1.28 0.58 114.93 117.04 2hxy h MET 320 Ca -0.04 0.04 0.45 0.00 -2.06 0.00 0.00 59.70 58.08 2hxy h MET 320 Cb 1.11 0.13 -0.12 0.00 0.06 0.00 0.00 31.60 32.78 2hxy h MET 320 CO 0.06 -0.37 0.88 1.63 1.06 0.00 0.00 176.91 180.16 2hxy n LYS 321 N -5.26 -0.03 0.00 1.72 5.02 -0.04 0.50 118.16 120.07 2hxy n LYS 321 Ca -0.06 1.11 0.00 0.00 -2.02 0.00 0.00 58.31 57.34 2hxy n LYS 321 Cb 0.36 -2.25 0.00 0.00 -0.02 0.00 0.00 35.03 33.13 2hxy n LYS 321 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2hxy n GLU 322 N -4.40 0.00 -0.20 1.97 1.02 0.19 -2.83 120.64 116.39 2hxy n GLU 322 Ca 0.37 0.43 0.00 0.00 -0.02 0.00 0.00 57.16 57.94 2hxy n GLU 322 Cb 1.48 -1.18 0.09 0.00 -0.02 0.00 0.00 31.44 31.82 2hxy n GLU 322 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 2hxy h PHE 323 N 0.00 -0.03 -0.34 -0.32 3.57 1.00 -1.42 116.94 119.39 2hxy h PHE 323 Ca 0.00 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 2hxy h PHE 323 Cb 0.00 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 2hxy h PHE 323 CO 0.10 -0.15 0.12 0.07 -2.23 0.00 0.00 178.31 176.22 2hxy h ARG 324 N 0.12 0.49 0.72 1.11 0.11 -0.11 -2.82 114.38 114.00 2hxy h ARG 324 Ca 0.31 -0.06 -0.04 0.00 0.10 0.00 0.00 59.98 60.29 2hxy h ARG 324 Cb 0.50 -0.09 0.01 0.00 1.11 0.00 0.00 29.97 31.49 2hxy h ARG 324 CO -0.51 0.42 -0.35 1.03 0.10 0.00 0.00 179.97 180.66 2hxy h SER 325 N 0.49 -0.82 0.00 0.08 0.87 -1.14 -3.47 113.55 109.55 2hxy h SER 325 Ca 0.12 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 2hxy h SER 325 Cb 0.13 0.21 0.00 0.00 -0.44 0.00 0.00 62.40 62.30 2hxy h SER 325 CO -0.01 -0.47 0.00 0.61 -0.53 0.00 0.00 176.83 176.43 2hxy n GLY 326 N -0.93 0.30 0.20 5.77 0.00 -0.76 -5.03 105.19 104.76 2hxy n GLY 326 Ca -0.13 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.07 2hxy n GLY 326 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hxy n ALA 327 N 0.00 0.57 -2.60 4.61 0.00 -0.63 -4.32 120.51 118.14 2hxy n ALA 327 Ca 0.00 0.65 -0.22 0.00 0.00 0.00 0.00 53.44 53.87 2hxy n ALA 327 Cb 0.00 -0.60 -0.13 0.00 0.00 0.00 0.00 19.45 18.72 2hxy n ALA 327 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2hxy s SER 328 N -4.77 2.10 0.03 0.00 1.04 -1.26 -4.96 113.70 105.88 2hxy s SER 328 Ca -0.06 -0.59 0.09 0.00 0.48 0.00 0.00 55.95 55.86 2hxy s SER 328 Cb 0.21 -0.12 -0.23 0.00 0.10 0.00 0.00 66.02 65.98 2hxy s SER 328 CO 0.49 0.03 0.93 0.03 0.98 0.00 0.00 173.24 175.70 2hxy h ARG 329 N 4.46 0.03 -5.61 4.02 2.47 -0.92 -3.44 114.38 115.39 2hxy h ARG 329 Ca -0.42 -0.05 -0.61 0.00 -1.26 0.00 0.00 59.98 57.64 2hxy h ARG 329 Cb 1.18 0.02 -0.31 0.00 -1.65 0.00 0.00 29.97 29.21 2hxy h ARG 329 CO 0.41 0.77 -0.86 0.08 0.56 0.00 0.00 179.97 180.94 2hxy s VAL 330 N -2.65 1.67 -0.25 2.04 1.01 -1.03 -2.25 120.40 118.95 2hxy s VAL 330 Ca -0.03 -0.86 -0.02 0.00 0.00 0.00 0.00 61.98 61.08 2hxy s VAL 330 Cb 0.09 -1.42 0.03 0.00 0.00 0.00 0.00 36.38 35.07 2hxy s VAL 330 CO 0.82 0.47 -0.06 -0.22 0.00 0.00 0.00 175.10 176.12 2hxy s LEU 331 N -0.08 3.19 -0.14 3.92 2.96 0.83 -1.92 118.68 127.43 2hxy s LEU 331 Ca -0.03 -0.86 -0.04 0.00 -0.22 0.00 0.00 54.13 52.98 2hxy s LEU 331 Cb -0.12 -1.67 -0.03 0.00 0.50 0.00 0.00 46.19 44.87 2hxy s LEU 331 CO 0.02 -0.13 0.00 -0.63 -1.32 0.00 0.00 176.35 174.30 2hxy s ILE 332 N 1.33 4.29 -0.05 6.68 1.01 -0.82 0.98 121.20 134.62 2hxy s ILE 332 Ca 0.00 -0.23 -0.31 0.00 0.00 0.00 0.00 60.65 60.12 2hxy s ILE 332 Cb -0.17 -2.87 0.11 0.00 0.01 0.00 0.00 42.46 39.54 2hxy s ILE 332 CO -0.04 0.52 1.05 -0.55 0.00 0.00 0.00 174.94 175.91 2hxy s SER 333 N -0.01 -0.23 0.24 3.58 0.15 -0.06 -1.85 113.70 115.51 2hxy s SER 333 Ca 0.03 -0.07 -0.17 0.00 0.70 0.00 0.00 55.95 56.44 2hxy s SER 333 Cb -0.13 0.29 -0.08 0.00 -1.71 0.00 0.00 66.02 64.39 2hxy s SER 333 CO 0.02 -0.49 0.70 0.42 1.20 0.00 0.00 173.24 175.09 2hxy s THR 334 N -2.83 4.65 -0.88 6.45 -4.23 -1.12 -2.16 115.64 115.51 2hxy s THR 334 Ca 0.08 1.11 -0.24 0.00 -1.18 0.00 0.00 61.69 61.46 2hxy s THR 334 Cb -0.00 -3.77 -0.18 0.00 1.34 0.00 0.00 72.50 69.89 2hxy s THR 334 CO -0.06 0.09 2.24 -0.67 -0.54 0.00 0.00 174.62 175.69 2hxy n ASP 335 N 0.39 1.31 0.00 3.99 -0.08 -1.26 -4.56 116.55 116.35 2hxy n ASP 335 Ca -0.01 -1.81 0.10 0.00 -1.51 0.00 0.00 54.79 51.57 2hxy n ASP 335 Cb 0.52 -1.59 -0.10 0.00 2.34 0.00 0.00 41.12 42.28 2hxy n ASP 335 CO 0.00 0.00 0.00 0.55 0.12 0.00 0.00 177.20 177.87 2hxy n VAL 336 N 8.59 0.02 -2.26 5.18 3.14 -1.26 -4.90 118.33 126.84 2hxy n VAL 336 Ca 0.44 -0.14 -0.43 0.00 -2.96 0.00 0.00 64.34 61.26 2hxy n VAL 336 Cb 0.43 0.67 -0.02 0.00 -1.06 0.00 0.00 33.84 33.86 2hxy n VAL 336 CO 0.00 0.00 0.00 0.26 -6.46 0.00 0.00 176.83 170.63 2hxy s TRP 337 N -3.14 2.39 0.09 1.45 0.51 -1.26 -4.87 118.94 114.11 2hxy s TRP 337 Ca 0.04 0.69 -0.25 0.00 -2.12 0.00 0.00 56.10 54.47 2hxy s TRP 337 Cb 0.15 -3.91 -0.13 0.00 -0.81 0.00 0.00 33.47 28.77 2hxy s TRP 337 CO 0.87 -2.40 1.70 0.00 -0.51 0.00 0.00 176.95 176.61 2hxy h ALA 338 N 9.88 -0.21 -3.00 0.98 0.00 -1.98 -3.41 119.26 121.52 2hxy h ALA 338 Ca -0.30 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2hxy h ALA 338 Cb 1.13 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2hxy h ALA 338 CO 1.01 -0.63 0.00 0.54 0.00 0.00 0.00 179.25 180.17 2hxy n ARG 339 N -5.21 0.27 0.00 0.00 1.74 -1.26 -5.04 116.66 107.16 2hxy n ARG 339 Ca -0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 2hxy n ARG 339 Cb 0.14 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.58 2hxy n ARG 339 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2hxy n GLY 340 N 4.07 0.00 0.27 -0.13 0.00 -1.26 -4.73 105.19 103.41 2hxy n GLY 340 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.19 2hxy n GLY 340 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2hxy h LEU 341 N 0.00 0.00 -1.96 0.99 4.07 -1.95 -3.31 115.31 113.15 2hxy h LEU 341 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2hxy h LEU 341 Cb 0.94 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.68 2hxy h LEU 341 CO 0.00 0.00 0.00 0.47 -1.08 0.00 0.00 178.44 177.83 2hxy n ASP 342 N -3.10 2.11 -4.64 -0.43 8.00 -1.26 -4.81 116.55 112.43 2hxy n ASP 342 Ca 0.01 -1.45 -0.35 0.00 0.71 0.00 0.00 54.79 53.71 2hxy n ASP 342 Cb 0.33 -0.36 -0.10 0.00 -0.02 0.00 0.00 41.12 40.97 2hxy n ASP 342 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2hxy s VAL 343 N 0.23 4.89 -0.83 2.53 -7.23 -1.25 -4.99 120.40 113.74 2hxy s VAL 343 Ca 0.00 0.00 -0.35 0.00 -1.81 0.00 0.00 61.98 59.83 2hxy s VAL 343 Cb 0.00 -3.22 -0.21 0.00 0.56 0.00 0.00 36.38 33.52 2hxy s VAL 343 CO 0.00 0.44 2.52 -2.65 -0.31 0.00 0.00 175.10 175.11 2hxy n PRO 344 N 3.66 0.04 -2.42 4.82 -0.02 -1.26 -4.78 135.00 135.04 2hxy n PRO 344 Ca -0.16 0.01 -0.41 0.00 -2.02 0.00 0.00 63.50 60.91 2hxy n PRO 344 Cb 0.52 -1.56 -0.03 0.00 -0.02 0.00 0.00 33.50 32.41 2hxy n PRO 344 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2hxy s GLN 345 N 8.08 3.21 0.50 -0.52 -1.52 -1.26 -4.95 119.66 123.20 2hxy s GLN 345 Ca 1.30 0.24 0.05 0.00 -1.95 0.00 0.00 55.36 55.00 2hxy s GLN 345 Cb -1.30 -4.16 0.01 0.00 -0.22 0.00 0.00 33.01 27.34 2hxy s GLN 345 CO 0.53 -2.07 0.28 0.54 -0.25 0.00 0.00 175.29 174.33 2hxy s VAL 346 N 6.20 1.79 -0.57 1.09 0.11 -1.26 -4.80 120.40 122.96 2hxy s VAL 346 Ca 0.48 -1.61 0.24 0.00 -2.93 0.00 0.00 61.98 58.16 2hxy s VAL 346 Cb -0.10 -2.40 0.23 0.00 -1.53 0.00 0.00 36.38 32.59 2hxy s VAL 346 CO 0.21 0.00 1.57 0.77 -3.33 0.00 0.00 175.10 174.32 2hxy h SER 347 N 1.02 0.00 -3.37 3.54 4.64 -1.91 -3.45 113.55 114.01 2hxy h SER 347 Ca -0.40 -0.04 -0.43 0.00 -0.47 0.00 0.00 61.79 60.46 2hxy h SER 347 Cb 1.29 0.00 -0.35 0.00 -0.31 0.00 0.00 62.40 63.03 2hxy h SER 347 CO 0.63 0.02 -0.77 -0.22 -0.87 0.00 0.00 176.83 175.62 2hxy s LEU 348 N -5.09 1.08 -0.06 5.97 2.96 -1.26 -2.55 118.68 119.74 2hxy s LEU 348 Ca 0.08 -0.13 0.06 0.00 -0.22 0.00 0.00 54.13 53.92 2hxy s LEU 348 Cb 0.10 -0.48 -0.01 0.00 0.50 0.00 0.00 46.19 46.30 2hxy s LEU 348 CO 0.66 -0.10 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.72 2hxy s ILE 349 N 1.31 1.98 -0.07 6.68 -1.09 -0.90 -1.65 121.20 127.46 2hxy s ILE 349 Ca -0.05 -1.03 0.03 0.00 -2.23 0.00 0.00 60.65 57.38 2hxy s ILE 349 Cb -0.14 -1.68 0.00 0.00 -1.58 0.00 0.00 42.46 39.07 2hxy s ILE 349 CO -0.02 0.55 -0.17 -0.63 -1.23 0.00 0.00 174.94 173.43 2hxy s ILE 350 N -0.15 1.53 -0.68 2.92 1.01 -0.58 -0.59 121.20 124.66 2hxy s ILE 350 Ca -0.03 -0.72 -0.16 0.00 0.00 0.00 0.00 60.65 59.73 2hxy s ILE 350 Cb -0.13 -1.34 0.16 0.00 0.01 0.00 0.00 42.46 41.15 2hxy s ILE 350 CO 0.03 0.44 0.68 0.20 0.00 0.00 0.00 174.94 176.29 2hxy s ASN 351 N 0.40 6.42 0.56 3.58 0.01 0.13 -1.17 114.94 124.88 2hxy s ASN 351 Ca -0.13 -2.06 0.27 0.00 -0.71 0.00 0.00 52.86 50.22 2hxy s ASN 351 Cb -0.16 -2.24 1.61 0.00 0.41 0.00 0.00 41.25 40.88 2hxy s ASN 351 CO 0.05 -0.82 2.18 0.22 -1.51 0.00 0.00 177.10 177.22 2hxy h TYR 352 N 8.55 0.00 -3.92 2.20 3.20 -1.41 -1.68 116.97 123.90 2hxy h TYR 352 Ca -0.12 0.00 -0.31 0.00 3.14 0.00 0.00 58.73 61.44 2hxy h TYR 352 Cb 1.07 0.00 -0.20 0.00 1.54 0.00 0.00 36.73 39.14 2hxy h TYR 352 CO 0.89 0.05 -0.74 -0.51 -1.64 0.00 0.00 178.16 176.20 2hxy s ASP 353 N -6.31 1.16 0.43 -2.11 -0.00 -1.19 -4.70 116.67 103.95 2hxy s ASP 353 Ca -0.04 -0.63 -0.08 0.00 -0.00 0.00 0.00 52.55 51.79 2hxy s ASP 353 Cb 0.15 0.01 -0.05 0.00 -0.00 0.00 0.00 42.92 43.03 2hxy s ASP 353 CO 0.58 -0.19 0.77 -0.76 -0.00 0.00 0.00 175.17 175.57 2hxy s LEU 354 N -1.82 3.75 0.19 1.23 1.43 -1.26 -4.82 118.68 117.38 2hxy s LEU 354 Ca -0.05 1.05 -0.25 0.00 -1.03 0.00 0.00 54.13 53.86 2hxy s LEU 354 Cb -0.08 -3.96 -0.08 0.00 0.03 0.00 0.00 46.19 42.09 2hxy s LEU 354 CO 0.01 -0.47 0.79 -2.16 0.23 0.00 0.00 176.35 174.75 2hxy s PRO 355 N -4.18 4.55 -0.25 1.29 0.04 -1.26 -4.88 135.00 130.30 2hxy s PRO 355 Ca 0.50 1.16 0.03 0.00 0.04 0.00 0.00 61.00 62.72 2hxy s PRO 355 Cb -0.10 -3.18 0.41 0.00 0.04 0.00 0.00 34.50 31.66 2hxy s PRO 355 CO 0.37 0.53 1.50 0.09 0.04 0.00 0.00 177.00 179.53 2hxy n ASN 356 N 1.40 3.49 -3.35 6.66 3.02 -1.26 -4.69 115.26 120.53 2hxy n ASN 356 Ca -0.04 -2.90 -0.07 0.00 -0.03 0.00 0.00 54.58 51.53 2hxy n ASN 356 Cb 0.49 -0.69 -0.07 0.00 -0.61 0.00 0.00 39.78 38.90 2hxy n ASN 356 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2hxy s ASN 357 N -0.37 -0.01 0.13 6.41 0.01 -1.26 -5.04 114.94 114.81 2hxy s ASN 357 Ca 0.33 0.38 -0.01 0.00 -0.71 0.00 0.00 52.86 52.85 2hxy s ASN 357 Cb 0.28 1.27 0.28 0.00 0.41 0.00 0.00 41.25 43.49 2hxy s ASN 357 CO 0.07 -0.29 0.70 0.54 -1.51 0.00 0.00 177.10 176.61 2hxy n ARG 358 N 5.38 -0.04 0.27 -0.60 1.74 -1.26 -0.89 116.66 121.25 2hxy n ARG 358 Ca -0.04 0.68 0.16 0.00 -0.77 0.00 0.00 57.85 57.88 2hxy n ARG 358 Cb 0.50 -1.05 0.68 0.00 -1.02 0.00 0.00 32.46 31.58 2hxy n ARG 358 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 2hxy h GLU 359 N 0.00 0.00 -0.15 5.56 4.57 -1.97 -3.21 114.58 119.39 2hxy h GLU 359 Ca 0.24 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.42 2hxy h GLU 359 Cb 0.45 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.04 2hxy h GLU 359 CO -0.44 0.06 0.00 1.47 -1.18 0.00 0.00 179.01 178.92 2hxy n LEU 360 N -3.20 2.47 -0.04 1.64 -0.00 -0.07 -3.63 117.00 114.17 2hxy n LEU 360 Ca -0.00 -0.94 -0.16 0.00 -0.00 0.00 0.00 56.01 54.91 2hxy n LEU 360 Cb 0.31 -0.09 -0.07 0.00 -0.00 0.00 0.00 43.42 43.57 2hxy n LEU 360 CO 0.28 0.47 0.35 0.22 -0.00 0.00 0.00 177.39 178.71 2hxy h TYR 361 N 3.54 0.90 -0.14 1.47 3.20 -1.69 -0.98 116.97 123.28 2hxy h TYR 361 Ca 0.00 -0.38 -0.19 0.00 3.14 0.00 0.00 58.73 61.29 2hxy h TYR 361 Cb 0.76 -0.15 0.01 0.00 1.54 0.00 0.00 36.73 38.90 2hxy h TYR 361 CO 0.09 1.19 -0.67 0.97 -1.64 0.00 0.00 178.16 178.09 2hxy h ILE 362 N 0.37 1.31 0.00 1.81 -0.00 -1.78 0.20 117.51 119.41 2hxy h ILE 362 Ca -0.03 -1.91 0.00 0.00 -0.00 0.00 0.00 64.86 62.92 2hxy h ILE 362 Cb 1.23 2.06 0.00 0.00 -0.00 0.00 0.00 36.82 40.11 2hxy h ILE 362 CO 0.13 0.60 0.33 -0.74 -0.00 0.00 0.00 178.15 178.46 2hxy h HIS 363 N 0.39 0.00 0.00 2.19 2.76 -1.59 0.31 115.15 119.20 2hxy h HIS 363 Ca -0.05 0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.05 2hxy h HIS 363 Cb 1.31 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.26 2hxy h HIS 363 CO 0.10 0.00 -1.91 -2.13 -1.30 0.00 0.00 177.93 172.69 2hxy n ARG 364 N -2.65 0.71 0.00 5.26 0.63 -0.13 -4.69 116.66 115.79 2hxy n ARG 364 Ca -0.02 -0.13 0.00 0.00 -0.92 0.00 0.00 57.85 56.78 2hxy n ARG 364 Cb 0.36 -1.43 0.00 0.00 0.45 0.00 0.00 32.46 31.84 2hxy n ARG 364 CO 0.00 0.00 0.00 0.44 -2.51 0.00 0.00 177.63 175.56 2hxy n ILE 365 N -2.25 0.12 -1.45 5.15 -5.35 -0.14 -5.06 119.36 110.37 2hxy n ILE 365 Ca -0.09 -0.20 -0.29 0.00 -0.27 0.00 0.00 62.75 61.89 2hxy n ILE 365 Cb 0.61 1.36 0.12 0.00 -1.74 0.00 0.00 39.64 39.99 2hxy n ILE 365 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2hxy s GLY 366 N -0.12 1.60 0.29 3.28 0.00 0.96 -4.95 107.32 108.38 2hxy s GLY 366 Ca 0.00 -0.29 0.04 0.00 0.00 0.00 0.00 44.72 44.47 2hxy s GLY 366 CO 0.00 0.20 0.01 1.09 0.00 0.00 0.00 173.10 174.40 2hxy s ARG 367 N -5.14 1.54 0.10 2.90 1.70 -1.24 -4.93 118.95 113.89 2hxy s ARG 367 Ca 0.63 -1.82 0.18 0.00 -0.47 0.00 0.00 55.73 54.25 2hxy s ARG 367 Cb -0.16 -0.88 0.77 0.00 -0.57 0.00 0.00 34.95 34.11 2hxy s ARG 367 CO 0.55 -0.10 1.57 0.45 -1.08 0.00 0.00 175.30 176.68 2hxy n SER 368 N -0.59 0.26 0.00 -2.89 2.88 -1.26 -2.70 113.62 109.32 2hxy n SER 368 Ca -0.04 0.56 0.00 0.00 -1.33 0.00 0.00 58.87 58.06 2hxy n SER 368 Cb 0.65 -0.62 0.00 0.00 -0.75 0.00 0.00 64.21 63.49 2hxy n SER 368 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2hxy n GLY 369 N 0.05 0.05 0.23 0.46 0.00 -1.26 -3.62 105.19 101.09 2hxy n GLY 369 Ca 0.03 -0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 2hxy n GLY 369 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2hxy h ARG 370 N 0.00 0.74 -0.00 1.61 2.43 -1.89 -3.36 114.38 113.91 2hxy h ARG 370 Ca 0.00 -0.47 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 2hxy h ARG 370 Cb 0.00 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 2hxy h ARG 370 CO 0.00 1.10 -0.02 0.66 -1.51 0.00 0.00 179.97 180.20 2hxy n TYR 371 N -3.98 0.00 -3.28 2.20 4.01 -1.24 -5.08 117.16 109.80 2hxy n TYR 371 Ca -0.04 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.44 2hxy n TYR 371 Cb 0.62 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.64 2hxy n TYR 371 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2hxy s GLY 372 N -0.54 1.60 0.01 2.72 0.00 -1.26 -4.94 107.32 104.91 2hxy s GLY 372 Ca 0.01 -0.70 -0.30 0.00 0.00 0.00 0.00 44.72 43.73 2hxy s GLY 372 CO 0.02 -0.61 1.08 0.50 0.00 0.00 0.00 173.10 174.10 2hxy s ARG 373 N -3.99 4.48 0.81 2.90 0.52 -1.26 -4.52 118.95 117.88 2hxy s ARG 373 Ca 0.43 1.57 -0.15 0.00 -0.52 0.00 0.00 55.73 57.06 2hxy s ARG 373 Cb -0.10 -3.44 0.01 0.00 0.52 0.00 0.00 34.95 31.94 2hxy s ARG 373 CO 0.34 -0.19 0.65 1.63 0.02 0.00 0.00 175.30 177.75 2hxy n LYS 374 N 4.13 0.11 0.00 3.54 5.02 -1.26 -4.97 118.16 124.73 2hxy n LYS 374 Ca 0.08 0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.46 2hxy n LYS 374 Cb 0.49 -1.98 0.00 0.00 -0.02 0.00 0.00 35.03 33.52 2hxy n LYS 374 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2hxy n GLY 375 N 1.36 4.38 3.63 0.72 0.00 -1.24 -4.92 105.19 109.12 2hxy n GLY 375 Ca 0.10 -0.80 -0.13 0.00 0.00 0.00 0.00 46.02 45.18 2hxy n GLY 375 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hxy s VAL 376 N -0.07 0.00 -0.00 1.61 1.01 -1.06 -2.97 120.40 118.92 2hxy s VAL 376 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 61.98 61.98 2hxy s VAL 376 Cb 0.00 -1.00 0.01 0.00 0.00 0.00 0.00 36.38 35.39 2hxy s VAL 376 CO 0.00 0.00 0.01 0.00 0.00 0.00 0.00 175.10 175.11 2hxy s ALA 377 N 0.37 0.01 -0.12 5.51 0.00 0.02 -2.12 121.76 125.43 2hxy s ALA 377 Ca 0.00 0.07 0.01 0.00 0.00 0.00 0.00 51.96 52.05 2hxy s ALA 377 Cb -0.05 -0.05 -0.01 0.00 0.00 0.00 0.00 23.12 23.01 2hxy s ALA 377 CO 0.00 -0.02 -0.17 0.42 0.00 0.00 0.00 175.76 175.99 2hxy s ILE 378 N 0.22 2.69 -0.23 0.00 1.01 0.24 -1.15 121.20 123.97 2hxy s ILE 378 Ca -0.02 -0.79 -0.08 0.00 0.00 0.00 0.00 60.65 59.76 2hxy s ILE 378 Cb -0.03 -2.10 -0.04 0.00 0.01 0.00 0.00 42.46 40.31 2hxy s ILE 378 CO -0.01 0.54 0.09 0.20 0.00 0.00 0.00 174.94 175.76 2hxy s ASN 379 N 0.35 5.49 -0.77 3.58 0.01 0.46 0.20 114.94 124.26 2hxy s ASN 379 Ca -0.14 -0.06 -0.19 0.00 -0.71 0.00 0.00 52.86 51.75 2hxy s ASN 379 Cb -0.17 -1.98 0.12 0.00 0.41 0.00 0.00 41.25 39.63 2hxy s ASN 379 CO 0.07 0.04 0.96 -0.36 -1.51 0.00 0.00 177.10 176.30 2hxy s PHE 380 N 1.19 3.02 -0.25 2.20 0.40 -0.63 -0.79 117.98 123.12 2hxy s PHE 380 Ca 0.05 -1.12 -0.12 0.00 -0.60 0.00 0.00 56.93 55.14 2hxy s PHE 380 Cb -0.14 -4.19 -0.05 0.00 0.51 0.00 0.00 43.02 39.15 2hxy s PHE 380 CO 0.04 -1.45 0.22 0.14 0.70 0.00 0.00 175.22 174.87 2hxy s VAL 381 N 2.85 5.30 0.22 -0.44 -7.23 -1.20 -4.48 120.40 115.43 2hxy s VAL 381 Ca 0.24 0.29 0.06 0.00 -1.81 0.00 0.00 61.98 60.75 2hxy s VAL 381 Cb -0.13 -3.56 -0.03 0.00 0.56 0.00 0.00 36.38 33.22 2hxy s VAL 381 CO -0.01 0.28 0.25 -1.59 -0.31 0.00 0.00 175.10 173.73 2hxy s LYS 382 N 1.41 3.15 0.00 4.82 -2.85 -1.26 -3.23 119.74 121.78 2hxy s LYS 382 Ca 0.10 -0.88 0.00 0.00 -1.00 0.00 0.00 55.97 54.19 2hxy s LYS 382 Cb -0.15 -2.73 0.00 0.00 -2.06 0.00 0.00 37.83 32.89 2hxy s LYS 382 CO 0.07 0.44 0.56 0.09 0.10 0.00 0.00 175.35 176.61 2hxy n ASN 383 N -1.04 0.00 -0.34 0.03 3.02 -1.11 0.12 115.26 115.93 2hxy n ASN 383 Ca -0.08 0.56 0.35 0.00 -0.03 0.00 0.00 54.58 55.38 2hxy n ASN 383 Cb 0.57 -0.26 0.54 0.00 -0.61 0.00 0.00 39.78 40.01 2hxy n ASN 383 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 2hxy h ASP 384 N 0.00 0.00 -0.01 6.41 3.32 -1.96 0.43 116.42 124.61 2hxy h ASP 384 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2hxy h ASP 384 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2hxy h ASP 384 CO 0.00 0.00 -0.22 0.47 -1.72 0.00 0.00 179.24 177.77 2hxy n ASP 385 N -3.43 1.15 0.31 6.45 8.00 0.32 -4.47 116.55 124.88 2hxy n ASP 385 Ca 0.29 -1.07 0.10 0.00 0.71 0.00 0.00 54.79 54.81 2hxy n ASP 385 Cb 1.66 0.51 0.54 0.00 -0.02 0.00 0.00 41.12 43.80 2hxy n ASP 385 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 2hxy h ILE 386 N 1.02 0.00 0.00 0.53 6.09 0.22 0.10 117.51 125.47 2hxy h ILE 386 Ca 0.00 0.00 -0.04 0.00 -1.37 0.00 0.00 64.86 63.45 2hxy h ILE 386 Cb 0.33 0.44 -0.01 0.00 0.47 0.00 0.00 36.82 38.05 2hxy h ILE 386 CO 0.00 0.00 -0.28 -0.09 -3.07 0.00 0.00 178.15 174.71 2hxy h ARG 387 N 0.00 0.00 -1.12 2.19 2.43 -1.78 -3.24 114.38 112.85 2hxy h ARG 387 Ca 0.00 0.00 0.33 0.00 -0.81 0.00 0.00 59.98 59.50 2hxy h ARG 387 Cb 1.01 0.00 -0.11 0.00 -0.42 0.00 0.00 29.97 30.44 2hxy h ARG 387 CO 0.00 0.66 0.71 0.82 -1.51 0.00 0.00 179.97 180.66 2hxy h ILE 388 N -1.00 0.37 -0.49 1.20 2.04 -1.09 0.46 117.51 119.00 2hxy h ILE 388 Ca -0.07 -0.10 -0.11 0.00 1.00 0.00 0.00 64.86 65.59 2hxy h ILE 388 Cb 0.77 0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 2hxy h ILE 388 CO -0.04 0.05 -0.10 0.25 0.00 0.00 0.00 178.15 178.31 2hxy h LEU 389 N 0.29 0.94 -1.94 1.44 5.85 -1.57 -1.38 115.31 118.95 2hxy h LEU 389 Ca 0.69 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 59.05 2hxy h LEU 389 Cb 1.87 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 42.64 2hxy h LEU 389 CO -0.38 1.08 0.00 0.03 -0.34 0.00 0.00 178.44 178.83 2hxy h ARG 390 N 0.80 0.00 0.00 1.25 2.47 -0.11 -0.50 114.38 118.28 2hxy h ARG 390 Ca 0.13 0.00 -0.09 0.00 -1.26 0.00 0.00 59.98 58.75 2hxy h ARG 390 Cb 0.66 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.96 2hxy h ARG 390 CO 0.05 0.00 -0.64 -0.44 0.56 0.00 0.00 179.97 179.50 2hxy h ASP 391 N 0.00 0.00 -0.88 7.04 3.32 -0.96 -3.08 116.42 121.86 2hxy h ASP 391 Ca 0.00 -0.41 0.19 0.00 0.02 0.00 0.00 57.03 56.84 2hxy h ASP 391 Cb 0.17 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 39.61 2hxy h ASP 391 CO 0.00 1.07 0.40 0.40 -1.72 0.00 0.00 179.24 179.39 2hxy h ILE 392 N -1.00 0.56 0.54 0.35 2.04 -0.96 0.81 117.51 119.84 2hxy h ILE 392 Ca -0.14 -0.16 -0.02 0.00 1.00 0.00 0.00 64.86 65.54 2hxy h ILE 392 Cb 0.86 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 2hxy h ILE 392 CO -0.09 0.09 -0.35 -0.08 0.00 0.00 0.00 178.15 177.72 2hxy h GLU 393 N 0.47 -0.82 0.00 2.37 4.81 -1.23 -2.42 114.58 117.76 2hxy h GLU 393 Ca 0.52 0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.79 2hxy h GLU 393 Cb 0.92 0.19 -0.00 0.00 0.63 0.00 0.00 28.75 30.49 2hxy h GLU 393 CO -0.47 -0.55 -0.12 1.96 -0.73 0.00 0.00 179.01 179.10 2hxy h GLN 394 N -0.85 0.00 0.46 1.92 1.08 -0.93 -2.22 115.11 114.56 2hxy h GLN 394 Ca -0.06 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.12 2hxy h GLN 394 Cb 0.71 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.14 2hxy h GLN 394 CO 0.05 0.12 -0.22 -0.92 -0.95 0.00 0.00 178.83 176.91 2hxy h TYR 395 N 0.00 -0.57 -0.05 2.96 3.20 0.10 -2.91 116.97 119.71 2hxy h TYR 395 Ca -0.00 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 2hxy h TYR 395 Cb 0.22 0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.67 2hxy h TYR 395 CO 0.00 -0.35 0.00 0.66 -1.64 0.00 0.00 178.16 176.83 2hxy n TYR 396 N -3.84 0.10 -4.00 -3.82 4.02 -1.02 -4.88 117.16 103.72 2hxy n TYR 396 Ca -0.08 -0.04 -0.40 0.00 -0.01 0.00 0.00 57.90 57.38 2hxy n TYR 396 Cb 0.24 -0.05 0.01 0.00 -0.02 0.00 0.00 39.34 39.53 2hxy n TYR 396 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 2hxy n SER 397 N -0.20 -3.81 -4.05 7.72 7.64 -1.00 -4.95 113.62 114.96 2hxy n SER 397 Ca 0.02 -1.14 -0.18 0.00 1.01 0.00 0.00 58.87 58.58 2hxy n SER 397 Cb 0.15 -1.43 -0.09 0.00 -1.01 0.00 0.00 64.21 61.82 2hxy n SER 397 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2hxy s THR 398 N -3.53 0.35 0.02 0.44 -1.32 -0.87 -5.05 115.64 105.69 2hxy s THR 398 Ca 0.37 -2.00 0.04 0.00 -1.21 0.00 0.00 61.69 58.89 2hxy s THR 398 Cb -0.21 -2.53 -0.03 0.00 -1.51 0.00 0.00 72.50 68.22 2hxy s THR 398 CO 0.87 0.00 -0.08 -1.58 -2.21 0.00 0.00 174.62 171.62 2hxy s GLN 399 N -3.87 2.45 -0.14 7.08 0.74 -1.26 -4.59 119.66 120.08 2hxy s GLN 399 Ca 0.36 -0.79 -0.01 0.00 0.05 0.00 0.00 55.36 54.97 2hxy s GLN 399 Cb 0.06 -2.45 0.04 0.00 1.10 0.00 0.00 33.01 31.76 2hxy s GLN 399 CO 0.17 0.58 -0.01 0.42 -0.55 0.00 0.00 175.29 175.89 2hxy s ILE 400 N -1.02 0.70 0.28 -2.34 1.01 -1.26 -4.66 121.20 113.91 2hxy s ILE 400 Ca 0.18 -0.32 0.06 0.00 0.00 0.00 0.00 60.65 60.57 2hxy s ILE 400 Cb -0.11 -0.94 -0.03 0.00 0.01 0.00 0.00 42.46 41.39 2hxy s ILE 400 CO 0.08 0.11 0.33 -1.81 0.00 0.00 0.00 174.94 173.66 2hxy s ASP 401 N 1.81 5.85 0.23 3.58 1.01 -1.10 -4.89 116.67 123.17 2hxy s ASP 401 Ca 0.02 -0.17 -0.25 0.00 0.71 0.00 0.00 52.55 52.86 2hxy s ASP 401 Cb -0.14 -1.44 -0.09 0.00 1.01 0.00 0.00 42.92 42.26 2hxy s ASP 401 CO -0.07 -0.19 0.82 -0.70 0.21 0.00 0.00 175.17 175.24 2hxy s GLU 402 N -3.99 4.53 -0.04 8.23 2.12 -1.26 -0.91 118.70 127.37 2hxy s GLU 402 Ca 0.37 1.16 -0.30 0.00 0.36 0.00 0.00 54.97 56.57 2hxy s GLU 402 Cb -0.08 -3.06 -0.08 0.00 0.26 0.00 0.00 34.13 31.17 2hxy s GLU 402 CO 0.28 0.45 2.03 -1.33 -0.54 0.00 0.00 175.26 176.15 2hxy n MET 403 N 1.11 2.56 -2.17 4.30 2.81 -0.96 -4.87 117.12 119.90 2hxy n MET 403 Ca -0.03 0.89 -0.28 0.00 -1.81 0.00 0.00 57.70 56.48 2hxy n MET 403 Cb 0.49 -3.02 0.04 0.00 -0.71 0.00 0.00 33.22 30.02 2hxy n MET 403 CO 0.00 0.00 0.00 -2.14 1.51 0.00 0.00 175.97 175.34 2hxy s PRO 404 N 4.92 2.91 0.56 0.03 0.02 -1.26 -4.96 135.00 137.21 2hxy s PRO 404 Ca 0.93 0.21 0.33 0.00 0.02 0.00 0.00 61.00 62.49 2hxy s PRO 404 Cb -0.44 -2.16 1.61 0.00 0.02 0.00 0.00 34.50 33.52 2hxy s PRO 404 CO 0.42 -0.84 2.09 0.52 -0.33 0.00 0.00 177.00 178.86 2hxy h MET 405 N -0.38 0.00 -5.28 5.54 2.86 -2.06 -3.42 114.93 112.19 2hxy h MET 405 Ca -0.45 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.18 2hxy h MET 405 Cb 1.25 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.91 2hxy h MET 405 CO 0.62 0.06 0.02 -0.80 1.06 0.00 0.00 176.91 177.87 2hxy s ASN 406 N -5.77 3.74 0.00 1.22 0.01 -1.26 -4.68 114.94 108.19 2hxy s ASN 406 Ca -0.02 -0.24 0.06 0.00 -0.71 0.00 0.00 52.86 51.95 2hxy s ASN 406 Cb 0.11 -2.56 0.26 0.00 0.41 0.00 0.00 41.25 39.47 2hxy s ASN 406 CO 0.53 -4.16 1.18 1.33 -1.51 0.00 0.00 177.10 174.48 2hxy n VAL 407 N 8.88 0.09 -1.06 1.60 0.24 -1.26 -3.86 118.33 122.95 2hxy n VAL 407 Ca 0.45 -0.10 -0.20 0.00 -2.04 0.00 0.00 64.34 62.45 2hxy n VAL 407 Cb 0.44 0.01 0.02 0.00 -1.47 0.00 0.00 33.84 32.85 2hxy n VAL 407 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2hxy n ALA 408 N -0.32 5.52 -0.33 2.33 0.00 -1.26 -3.70 120.51 122.75 2hxy n ALA 408 Ca 0.05 -2.12 0.00 0.00 0.00 0.00 0.00 53.44 51.37 2hxy n ALA 408 Cb 0.08 -1.58 0.00 0.00 0.00 0.00 0.00 19.45 17.95 2hxy n ALA 408 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2hxy n ASP 409 N 0.37 0.02 -0.17 0.00 8.00 -1.25 -4.70 116.55 118.81 2hxy n ASP 409 Ca 0.37 -0.36 0.15 0.00 0.71 0.00 0.00 54.79 55.66 2hxy n ASP 409 Cb 0.58 0.03 0.79 0.00 -0.02 0.00 0.00 41.12 42.50 2hxy n ASP 409 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2hxy n LEU 410 N -0.03 0.54 -0.31 0.64 0.00 -1.24 -4.11 117.00 112.48 2hxy n LEU 410 Ca 0.00 -0.18 0.32 0.00 0.00 0.00 0.00 56.01 56.15 2hxy n LEU 410 Cb 0.08 -0.00 0.69 0.00 0.00 0.00 0.00 43.42 44.19 2hxy n LEU 410 CO 0.00 0.09 1.29 0.40 0.00 0.00 0.00 177.39 179.17 2hxy h ILE 411 N 0.84 0.44 -1.29 1.96 2.04 -1.84 -3.41 117.51 116.25 2hxy h ILE 411 Ca 0.00 -0.03 -0.53 0.00 1.00 0.00 0.00 64.86 65.29 2hxy h ILE 411 Cb 0.18 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 2hxy h ILE 411 CO 0.00 0.02 1.59 0.00 0.00 0.00 0.00 178.15 179.76 2hxy n LEU 412 N -4.31 2.09 0.00 1.44 -0.00 -1.26 -5.24 117.00 109.73 2hxy n LEU 412 Ca 0.25 -0.09 0.00 0.00 -0.00 0.00 0.00 56.01 56.17 2hxy n LEU 412 Cb 1.14 -1.40 0.00 0.00 -0.00 0.00 0.00 43.42 43.16 2hxy n LEU 412 CO 0.36 -1.12 0.00 -0.62 -0.00 0.00 0.00 177.39 176.01